Starting installation of Amber9 (serial) at Sat Apr 29 16:06:12 EDT 2006. cd lib; make install /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND new2oldparm.f > _new2oldparm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o new2oldparm.o _new2oldparm.f ** _main === End of Compilation 1 === 1501-510 Compilation successful for file _new2oldparm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND nxtsec.f > _nxtsec.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o nxtsec.o _nxtsec.f ** nxtsec === End of Compilation 1 === ** nnbchr === End of Compilation 2 === ** nxtsec_crd === End of Compilation 3 === ** nxtsec_crd_reset === End of Compilation 4 === 1501-510 Compilation successful for file _nxtsec.f. xlf90 -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -o new2oldparm new2oldparm.o nxtsec.o mv new2oldparm ../../exe /bin/rm _*.f cd addles; make install /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND lesmain.f > _lesmain.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o lesmain.o _lesmain.f ** _main === End of Compilation 1 === 1501-510 Compilation successful for file _lesmain.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND addspace.f > _addspace.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o addspace.o _addspace.f ** addspace === End of Compilation 1 === 1501-510 Compilation successful for file _addspace.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND readprm.f > _readprm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o readprm.o _readprm.f ** readprm === End of Compilation 1 === 1501-510 Compilation successful for file _readprm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND writprm.f > _writprm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o writprm.o _writprm.f ** writprm === End of Compilation 1 === 1501-510 Compilation successful for file _writprm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND readcrd.f > _readcrd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o readcrd.o _readcrd.f ** readcrd === End of Compilation 1 === 1501-510 Compilation successful for file _readcrd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND writcrd.f > _writcrd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o writcrd.o _writcrd.f ** writcrd === End of Compilation 1 === 1501-510 Compilation successful for file _writcrd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND pick.f > _pick.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o pick.o _pick.f ** pick === End of Compilation 1 === ** pick2 === End of Compilation 2 === 1501-510 Compilation successful for file _pick.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND rline.f > _rline.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o rline.o _rline.f ** rline === End of Compilation 1 === 1501-510 Compilation successful for file _rline.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND nxt.f > _nxt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o nxt.o _nxt.f ** nxt === End of Compilation 1 === 1501-510 Compilation successful for file _nxt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND intgr.f > _intgr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o intgr.o _intgr.f ** intgr === End of Compilation 1 === 1501-510 Compilation successful for file _intgr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND find.f > _find.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o find.o _find.f ** find === End of Compilation 1 === 1501-510 Compilation successful for file _find.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND of.f > _of.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o of.o _of.f ** of === End of Compilation 1 === 1501-510 Compilation successful for file _of.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND geti.f > _geti.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o geti.o _geti.f ** geti === End of Compilation 1 === 1501-510 Compilation successful for file _geti.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND unit.f > _unit.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o unit.o _unit.f ** getunit === End of Compilation 1 === 1501-510 Compilation successful for file _unit.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND getc.f > _getc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o getc.o _getc.f ** getc === End of Compilation 1 === 1501-510 Compilation successful for file _getc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND alert.f > _alert.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o alert.o _alert.f ** alert === End of Compilation 1 === 1501-510 Compilation successful for file _alert.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND echo.f > _echo.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o echo.o _echo.f ** echo === End of Compilation 1 === 1501-510 Compilation successful for file _echo.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND get4c.f > _get4c.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o get4c.o _get4c.f ** get4c === End of Compilation 1 === 1501-510 Compilation successful for file _get4c.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND getd.f > _getd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o getd.o _getd.f ** getd === End of Compilation 1 === 1501-510 Compilation successful for file _getd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND wlesprm.f > _wlesprm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o wlesprm.o _wlesprm.f ** wlesprm === End of Compilation 1 === 1501-510 Compilation successful for file _wlesprm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND lesprm.f > _lesprm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o lesprm.o _lesprm.f ** lesprm === End of Compilation 1 === 1501-510 Compilation successful for file _lesprm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND les2prm.f > _les2prm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o les2prm.o _les2prm.f ** les2prm === End of Compilation 1 === 1501-510 Compilation successful for file _les2prm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND checksz.f > _checksz.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o checksz.o _checksz.f ** checksz === End of Compilation 1 === 1501-510 Compilation successful for file _checksz.f. cd ../lib; ./Makelist ../lib/random.o ../lib/mexit.o ../lib/nxtsec.o /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND random.f > _random.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o random.o _random.f ** raset === End of Compilation 1 === ** amrset === End of Compilation 2 === ** amrand === End of Compilation 3 === ** gauss === End of Compilation 4 === 1501-510 Compilation successful for file _random.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND mexit.f > _mexit.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o mexit.o _mexit.f ** mexit === End of Compilation 1 === 1501-510 Compilation successful for file _mexit.f. make[2]: `nxtsec.o' is up to date. xlf90 -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -o addles lesmain.o addspace.o readprm.o writprm.o readcrd.o writcrd.o pick.o rline.o nxt.o intgr.o find.o of.o geti.o unit.o getc.o alert.o echo.o get4c.o getd.o wlesprm.o lesprm.o les2prm.o checksz.o ../lib/random.o ../lib/mexit.o ../lib/nxtsec.o -Wl,-framework -Wl,Accelerate mv addles ../../exe cd sander; make serial ./checkserconf /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_vars.f > _evb_vars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o evb_vars.o _evb_vars.f ** evb_nml === End of Compilation 1 === ** evb_amber === End of Compilation 2 === ** evb_parm === End of Compilation 3 === ** evb_xchff === End of Compilation 4 === ** evb_xdat === End of Compilation 5 === ** evb_mv === End of Compilation 6 === ** evb_data === End of Compilation 7 === "_evb_vars.f", line 496.36: 1514-129 (E) Previous specified type does not agree with the actual type of the INTRINSIC function. Type is ignored. "_evb_vars.f", line 496.63: 1514-129 (E) Previous specified type does not agree with the actual type of the INTRINSIC function. Type is ignored. ** evb_check === End of Compilation 8 === ** evb_math === End of Compilation 9 === 1501-510 Compilation successful for file _evb_vars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_input.f > _evb_input.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o evb_input.o _evb_input.f ** evb_input === End of Compilation 1 === ** evb_input_alloc === End of Compilation 2 === ** evb_input_dealloc === End of Compilation 3 === 1501-510 Compilation successful for file _evb_input.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_init.f > _evb_init.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o evb_init.o _evb_init.f ** evb_init === End of Compilation 1 === ** evb_init_alloc === End of Compilation 2 === ** evb_init_dealloc === End of Compilation 3 === 1501-510 Compilation successful for file _evb_init.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_alloc.f > _evb_alloc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o evb_alloc.o _evb_alloc.f ** evb_alloc === End of Compilation 1 === 1501-510 Compilation successful for file _evb_alloc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_dealloc.f > _evb_dealloc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o evb_dealloc.o _evb_dealloc.f ** evb_dealloc === End of Compilation 1 === 1501-510 Compilation successful for file _evb_dealloc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND check_input.f > _check_input.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o check_input.o _check_input.f ** check_input === End of Compilation 1 === 1501-510 Compilation successful for file _check_input.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_io.f > _evb_io.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o evb_io.o _evb_io.f ** evb_io === End of Compilation 1 === ** evb_io_alloc === End of Compilation 2 === ** evb_io_dealloc === End of Compilation 3 === 1501-510 Compilation successful for file _evb_io.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_keywrd.f > _evb_keywrd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o evb_keywrd.o _evb_keywrd.f ** evb_keywrd === End of Compilation 1 === 1501-510 Compilation successful for file _evb_keywrd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND exchange_CM.f > _exchange_CM.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o exchange_CM.o _exchange_CM.f "_exchange_CM.f", line 74.57: 1514-129 (E) Previous specified type does not agree with the actual type of the INTRINSIC function. Type is ignored. ** exchange_cm === End of Compilation 1 === ** xch_mv_type_alloc === End of Compilation 2 === ** xch_mv_type_dealloc === End of Compilation 3 === 1501-510 Compilation successful for file _exchange_CM.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_mcp.f > _evb_mcp.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o evb_mcp.o _evb_mcp.f ** evb_mcp === End of Compilation 1 === ** mcp_mv_type_alloc === End of Compilation 2 === ** mcp_mv_type_dealloc === End of Compilation 3 === "_evb_mcp.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _evb_mcp.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_force.f > _evb_force.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o evb_force.o _evb_force.f ** evb_force === End of Compilation 1 === ** evb_frc_type_alloc === End of Compilation 2 === ** evb_frc_type_dealloc === End of Compilation 3 === 1501-510 Compilation successful for file _evb_force.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND diabatic.f > _diabatic.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o diabatic.o _diabatic.f ** diabatic === End of Compilation 1 === ** dia_mv_type_alloc === End of Compilation 2 === ** dia_mv_type_dealloc === End of Compilation 3 === 1501-510 Compilation successful for file _diabatic.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_2stdebug.f > _evb_2stdebug.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o evb_2stdebug.o _evb_2stdebug.f ** evb_2stdebug === End of Compilation 1 === 1501-510 Compilation successful for file _evb_2stdebug.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND egap_umb_2stdebug.f > _egap_umb_2stdebug.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o egap_umb_2stdebug.o _egap_umb_2stdebug.f ** egap_umb_2stdebug === End of Compilation 1 === 1501-510 Compilation successful for file _egap_umb_2stdebug.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND exchange_gauss.f > _exchange_gauss.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o exchange_gauss.o _exchange_gauss.f "_exchange_gauss.f", line 63.36: 1514-129 (E) Previous specified type does not agree with the actual type of the INTRINSIC function. Type is ignored. "_exchange_gauss.f", line 63.42: 1514-129 (E) Previous specified type does not agree with the actual type of the INTRINSIC function. Type is ignored. ** exchange_gauss === End of Compilation 1 === ** xch_gauss_type_alloc === End of Compilation 2 === ** xch_gauss_type_dealloc === End of Compilation 3 === 1501-510 Compilation successful for file _exchange_gauss.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND exchange_warshel.f > _exchange_warshel.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o exchange_warshel.o _exchange_warshel.f "_exchange_warshel.f", line 64.36: 1514-129 (E) Previous specified type does not agree with the actual type of the INTRINSIC function. Type is ignored. "_exchange_warshel.f", line 64.42: 1514-129 (E) Previous specified type does not agree with the actual type of the INTRINSIC function. Type is ignored. ** exchange_warshel === End of Compilation 1 === ** xch_warshel_type_alloc === End of Compilation 2 === ** xch_warshel_type_dealloc === End of Compilation 3 === 1501-510 Compilation successful for file _exchange_warshel.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND parms.f > _parms.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o parms.o _parms.f ** parms === End of Compilation 1 === 1501-510 Compilation successful for file _parms.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND morsify.f > _morsify.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o morsify.o _morsify.f "_morsify.f", line 69.36: 1514-129 (E) Previous specified type does not agree with the actual type of the INTRINSIC function. Type is ignored. "_morsify.f", line 69.42: 1514-129 (E) Previous specified type does not agree with the actual type of the INTRINSIC function. Type is ignored. ** morsify === End of Compilation 1 === ** morsify_init === End of Compilation 2 === 1501-510 Compilation successful for file _morsify.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND morse_anal2num.f > _morse_anal2num.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o morse_anal2num.o _morse_anal2num.f ** morse_anal2num === End of Compilation 1 === "_morse_anal2num.f", line 208.36: 1514-129 (E) Previous specified type does not agree with the actual type of the INTRINSIC function. Type is ignored. ** vmorse === End of Compilation 2 === 1501-510 Compilation successful for file _morse_anal2num.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_pimd_init.f > _evb_pimd_init.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o evb_pimd_init.o _evb_pimd_init.f ** evb_pimd === End of Compilation 1 === 1501-510 Compilation successful for file _evb_pimd_init.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_matrix.f > _evb_matrix.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o evb_matrix.o _evb_matrix.f ** evb_matrix === End of Compilation 1 === ** evb_mat_type_alloc === End of Compilation 2 === ** evb_mat_type_dealloc === End of Compilation 3 === 1501-510 Compilation successful for file _evb_matrix.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND evb_ntrfc.f > _evb_ntrfc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o evb_ntrfc.o _evb_ntrfc.f ** ntrfc_evb === End of Compilation 1 === 1501-510 Compilation successful for file _evb_ntrfc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND out_evb.f > _out_evb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o out_evb.o _out_evb.f ** out_evb === End of Compilation 1 === 1501-510 Compilation successful for file _out_evb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND constants.f > _constants.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o constants.o _constants.f ** constants === End of Compilation 1 === 1501-510 Compilation successful for file _constants.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND stack.f > _stack.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o stack.o _stack.f ** stack === End of Compilation 1 === 1501-510 Compilation successful for file _stack.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND findmask.f > _findmask.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o findmask.o _findmask.f ** findmask === End of Compilation 1 === 1501-510 Compilation successful for file _findmask.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qmmm_module.f > _qmmm_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qmmm_module.o _qmmm_module.f ** qmmm_module === End of Compilation 1 === 1501-510 Compilation successful for file _qmmm_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND trace.f > _trace.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o trace.o _trace.f ** trace === End of Compilation 1 === 1501-510 Compilation successful for file _trace.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND lmod.f > _lmod.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o lmod.o _lmod.f ** lmod_driver === End of Compilation 1 === 1501-510 Compilation successful for file _lmod.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND decomp.f > _decomp.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o decomp.o _decomp.f ** decomp === End of Compilation 1 === "_decomp.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _decomp.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND icosasurf.f > _icosasurf.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o icosasurf.o _icosasurf.f ** icosasurf === End of Compilation 1 === "_icosasurf.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _icosasurf.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND pimd_vars.f > _pimd_vars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o pimd_vars.o _pimd_vars.f ** pimd_vars === End of Compilation 1 === 1501-510 Compilation successful for file _pimd_vars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND egb.f > _egb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o egb.o _egb.f ** genborn === End of Compilation 1 === "_egb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _egb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sa_driver.f > _sa_driver.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o sa_driver.o _sa_driver.f ** solvent_accessibility === End of Compilation 1 === "_sa_driver.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _sa_driver.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND pb_force.f > _pb_force.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o pb_force.o _pb_force.f ** poisson_boltzmann === End of Compilation 1 === "_pb_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _pb_force.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND pb_exmol.f > _pb_exmol.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o pb_exmol.o _pb_exmol.f ** pb_exmol === End of Compilation 1 === "_pb_exmol.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _pb_exmol.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND pb_mpfrc.f > _pb_mpfrc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o pb_mpfrc.o _pb_mpfrc.f ** pb_mpfrc === End of Compilation 1 === "_pb_mpfrc.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _pb_mpfrc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND pb_direct.f > _pb_direct.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o pb_direct.o _pb_direct.f ** pb_directnocut === End of Compilation 1 === ** pb_directwtcut === End of Compilation 2 === "_pb_direct.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_pb_direct.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _pb_direct.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND pb_list.f > _pb_list.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o pb_list.o _pb_list.f ** pb_atmpart === End of Compilation 1 === ** pb_reslist === End of Compilation 2 === ** pb_atmlist === End of Compilation 3 === ** pb_setgrd === End of Compilation 4 === "_pb_list.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_pb_list.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_pb_list.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _pb_list.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND np_force.f > _np_force.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o np_force.o _np_force.f ** dispersion_cavity === End of Compilation 1 === "_np_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _np_force.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND relax_mat.f > _relax_mat.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o relax_mat.o _relax_mat.f ** relax_mat === End of Compilation 1 === "_relax_mat.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _relax_mat.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND nmr.f > _nmr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o nmr.o _nmr.f ** nmr === End of Compilation 1 === "_nmr.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _nmr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND multisander.f > _multisander.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o multisander.o _multisander.f ** multisander === End of Compilation 1 === 1501-510 Compilation successful for file _multisander.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND fastwt.f > _fastwt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o fastwt.o _fastwt.f ** fastwt === End of Compilation 1 === "_fastwt.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _fastwt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND nonbond_list.f > _nonbond_list.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o nonbond_list.o _nonbond_list.f ** nblist === End of Compilation 1 === "_nonbond_list.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _nonbond_list.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ew_bspline.f > _ew_bspline.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_bspline.o _ew_bspline.f ** ew_bspline === End of Compilation 1 === "_ew_bspline.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_bspline.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ew_recip.f > _ew_recip.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_recip.o _ew_recip.f ** ew_recip === End of Compilation 1 === "_ew_recip.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_recip.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND amoeba_mdin.f > _amoeba_mdin.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o amoeba_mdin.o _amoeba_mdin.f ** amoeba_mdin === End of Compilation 1 === 1501-510 Compilation successful for file _amoeba_mdin.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND amoeba_runmd.f > _amoeba_runmd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o amoeba_runmd.o _amoeba_runmd.f ** amoeba_runmd === End of Compilation 1 === "_amoeba_runmd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _amoeba_runmd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND amoeba_multipoles.f > _amoeba_multipoles.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o amoeba_multipoles.o _amoeba_multipoles.f "_amoeba_multipoles.f", line 304.24: 1514-038 (W) The literal string has length 24 which is longer than 1, the length of the variable being initialized. The string will be truncated. ** amoeba_multipoles === End of Compilation 1 === "_amoeba_multipoles.f", line 813.8: 1514-022 (W) Variable qind1 is in or is equivalenced to a named COMMON block. Variable must only be initialized in a BLOCK DATA subprogram. "_amoeba_multipoles.f", line 814.8: 1514-022 (W) Variable qind2 is in or is equivalenced to a named COMMON block. Variable must only be initialized in a BLOCK DATA subprogram. "_amoeba_multipoles.f", line 815.8: 1514-022 (W) Variable oind1 is in or is equivalenced to a named COMMON block. Variable must only be initialized in a BLOCK DATA subprogram. "_amoeba_multipoles.f", line 816.8: 1514-022 (W) Variable oind2 is in or is equivalenced to a named COMMON block. Variable must only be initialized in a BLOCK DATA subprogram. "_amoeba_multipoles.f", line 817.8: 1514-022 (W) Variable oind3 is in or is equivalenced to a named COMMON block. Variable must only be initialized in a BLOCK DATA subprogram. "_amoeba_multipoles.f", line 818.8: 1514-022 (W) Variable hind1 is in or is equivalenced to a named COMMON block. Variable must only be initialized in a BLOCK DATA subprogram. "_amoeba_multipoles.f", line 819.8: 1514-022 (W) Variable hind2 is in or is equivalenced to a named COMMON block. Variable must only be initialized in a BLOCK DATA subprogram. "_amoeba_multipoles.f", line 820.8: 1514-022 (W) Variable hind3 is in or is equivalenced to a named COMMON block. Variable must only be initialized in a BLOCK DATA subprogram. "_amoeba_multipoles.f", line 821.8: 1514-022 (W) Variable hind4 is in or is equivalenced to a named COMMON block. Variable must only be initialized in a BLOCK DATA subprogram. ** xform_mpole_matrix === End of Compilation 2 === ** xform_mpole_deriv_matrix === End of Compilation 3 === ** xform_mpole_field_matrix === End of Compilation 4 === ** xform_mpole === End of Compilation 5 === ** xform_field === End of Compilation 6 === "_amoeba_multipoles.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_amoeba_multipoles.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _amoeba_multipoles.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND amoeba_induced.f > _amoeba_induced.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o amoeba_induced.o _amoeba_induced.f ** amoeba_induced === End of Compilation 1 === ** am_induced_add_cart_to_dip === End of Compilation 2 === ** am_induced_fields_to_ind_dips === End of Compilation 3 === ** am_induced_sor_update === End of Compilation 4 === ** am_induced_rms_diff === End of Compilation 5 === "_amoeba_induced.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _amoeba_induced.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND amoeba_vdw.f > _amoeba_vdw.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o amoeba_vdw.o _amoeba_vdw.f ** amoeba_vdw === End of Compilation 1 === "_amoeba_vdw.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _amoeba_vdw.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND amoeba_adjust.f > _amoeba_adjust.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o amoeba_adjust.o _amoeba_adjust.f ** amoeba_adjust === End of Compilation 1 === "_amoeba_adjust.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _amoeba_adjust.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND amoeba_recip.f > _amoeba_recip.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o amoeba_recip.o _amoeba_recip.f ** amoeba_recip === End of Compilation 1 === "_amoeba_recip.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _amoeba_recip.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND amoeba_valence.f > _amoeba_valence.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o amoeba_valence.o _amoeba_valence.f ** amoeba_bonds === End of Compilation 1 === ** amoeba_ureyb === End of Compilation 2 === ** amoeba_reg_angles === End of Compilation 3 === ** amoeba_trig_angles === End of Compilation 4 === ** amoeba_opbend_angles === End of Compilation 5 === ** amoeba_torsions === End of Compilation 6 === ** amoeba_stretch_torsions === End of Compilation 7 === ** amoeba_pitorsions === End of Compilation 8 === ** amoeba_stretch_bend === End of Compilation 9 === ** amoeba_torsion_torsion === End of Compilation 10 === ** am_val_get_num_params === End of Compilation 11 === ** am_val_get_ftab_degree === End of Compilation 12 === ** am_val_read_force_constant === End of Compilation 13 === ** am_val_read_equil_value === End of Compilation 14 === ** am_val_read_periodicity === End of Compilation 15 === ** am_val_read_phase === End of Compilation 16 === ** am_val_read_ftable_coeffs === End of Compilation 17 === ** am_val_real_array_index === End of Compilation 18 === ** am_val_ftab_eval_f_df === End of Compilation 19 === ** am_val_geom_torsion === End of Compilation 20 === ** vec3d_unitperpto_unitvec === End of Compilation 21 === ** am_val_vec3d_get_perp_to_vecs === End of Compilation 22 === ** am_val_bcuint1 === End of Compilation 23 === ** am_val_bcucof === End of Compilation 24 === "_amoeba_valence.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_amoeba_valence.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_amoeba_valence.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_amoeba_valence.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_amoeba_valence.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_amoeba_valence.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_amoeba_valence.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_amoeba_valence.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_amoeba_valence.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_amoeba_valence.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_amoeba_valence.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_amoeba_valence.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _amoeba_valence.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND amoeba_direct.f > _amoeba_direct.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o amoeba_direct.o _amoeba_direct.f ** amoeba_direct === End of Compilation 1 === "_amoeba_direct.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _amoeba_direct.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND amoeba_self.f > _amoeba_self.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o amoeba_self.o _amoeba_self.f ** amoeba_self === End of Compilation 1 === "_amoeba_self.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _amoeba_self.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND amoeba_interface.f > _amoeba_interface.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o amoeba_interface.o _amoeba_interface.f ** amoeba_interface === End of Compilation 1 === ** amoeba_check_parm_legal === End of Compilation 2 === ** amoeba_check_newstyle_inpcrd === End of Compilation 3 === ** am_nonbond_perm_fields === End of Compilation 4 === ** am_nonbond_dip_dip_fields === End of Compilation 5 === ** am_nonbond_ene_frc === End of Compilation 6 === ** am_nonbond_remove_net_force === End of Compilation 7 === ** am_nonbond_set_user_bit === End of Compilation 8 === ** am_val_set_user_bit === End of Compilation 9 === ** amoeba_get_numlist === End of Compilation 10 === ** amoeba_read_list_data === End of Compilation 11 === ** amoeba_read_real_list_data === End of Compilation 12 === ** amoeba_read_real_scalar === End of Compilation 13 === ** amoeba_get_startlist_endlist === End of Compilation 14 === ** array_add === End of Compilation 15 === ** dump_dipoles === End of Compilation 16 === "_amoeba_interface.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _amoeba_interface.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sander.f > _sander.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o sander.o _sander.f ** sander === End of Compilation 1 === ** esp === End of Compilation 2 === 1501-510 Compilation successful for file _sander.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND trajene.f > _trajene.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o trajene.o _trajene.f ** trajene === End of Compilation 1 === 1501-510 Compilation successful for file _trajene.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND cshf.f > _cshf.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o cshf.o _cshf.f ** plane === End of Compilation 1 === ** cshf === End of Compilation 2 === ** elstat === End of Compilation 3 === "_cshf.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_cshf.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_cshf.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _cshf.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND nmrcal.f > _nmrcal.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o nmrcal.o _nmrcal.f ** nmrcal === End of Compilation 1 === ** restal === End of Compilation 2 === 1501-510 Compilation successful for file _nmrcal.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND pearsn.f > _pearsn.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o pearsn.o _pearsn.f ** pearsn === End of Compilation 1 === ** erfcc === End of Compilation 2 === 1501-510 Compilation successful for file _pearsn.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND printe.f > _printe.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o printe.o _printe.f ** report_min_results === End of Compilation 1 === ** report_min_progress === End of Compilation 2 === ** grdmax === End of Compilation 3 === ** printe === End of Compilation 4 === 1501-510 Compilation successful for file _printe.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND runmin.f > _runmin.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o runmin.o _runmin.f ** runmin === End of Compilation 1 === "_runmin.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _runmin.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND rdparm.f > _rdparm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o rdparm.o _rdparm.f ** rdparm1 === End of Compilation 1 === ** rdparm2 === End of Compilation 2 === ** istuff === End of Compilation 3 === 1501-510 Compilation successful for file _rdparm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND mdread.f > _mdread.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o mdread.o _mdread.f ** mdread1 === End of Compilation 1 === ** cnstphread === End of Compilation 2 === ** mdread2 === End of Compilation 3 === ** printflags === End of Compilation 4 === ** printflags2 === End of Compilation 5 === ** float_legal_range === End of Compilation 6 === ** int_legal_range === End of Compilation 7 === ** opt_legal_range === End of Compilation 8 === ** sander_bomb === End of Compilation 9 === 1501-510 Compilation successful for file _mdread.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND locmem.f > _locmem.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o locmem.o _locmem.f ** locmem === End of Compilation 1 === ** adj_mem_ptr === End of Compilation 2 === 1501-510 Compilation successful for file _locmem.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND bintraj.f > _bintraj.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o bintraj.o _bintraj.f ** bintraj === End of Compilation 1 === 1501-510 Compilation successful for file _bintraj.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND runmd.f > _runmd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o runmd.o _runmd.f ** runmd === End of Compilation 1 === ** quench === End of Compilation 2 === "_runmd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_runmd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _runmd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND getcor.f > _getcor.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o getcor.o _getcor.f ** getcor === End of Compilation 1 === 1501-510 Compilation successful for file _getcor.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND degcnt.f > _degcnt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o degcnt.o _degcnt.f ** degcnt === End of Compilation 1 === 1501-510 Compilation successful for file _degcnt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND decnvh.f > _decnvh.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o decnvh.o _decnvh.f ** decnvh === End of Compilation 1 === 1501-510 Compilation successful for file _decnvh.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND spatial_fft.f > _spatial_fft.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o spatial_fft.o _spatial_fft.f ** fft === End of Compilation 1 === 1501-510 Compilation successful for file _spatial_fft.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND parallel.f > _parallel.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o parallel.o _parallel.f ** dummy_parallel === End of Compilation 1 === 1501-510 Compilation successful for file _parallel.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND shake.f > _shake.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o shake.o _shake.f ** shake === End of Compilation 1 === "_shake.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _shake.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ene.f > _ene.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ene.o _ene.f ** bond === End of Compilation 1 === ** angl === End of Compilation 2 === ** ephi === End of Compilation 3 === ** capwat === End of Compilation 4 === ** xconst === End of Compilation 5 === ** xtgtmd === End of Compilation 6 === ** rmsfit === End of Compilation 7 === ** bellyf === End of Compilation 8 === "_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ene.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND mdwrit.f > _mdwrit.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o mdwrit.o _mdwrit.f ** mdwrit === End of Compilation 1 === ** mdwri2 === End of Compilation 2 === 1501-510 Compilation successful for file _mdwrit.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND minrit.f > _minrit.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o minrit.o _minrit.f ** minrit === End of Compilation 1 === 1501-510 Compilation successful for file _minrit.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND set.f > _set.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o set.o _set.f ** setatm === End of Compilation 1 === ** setbon === End of Compilation 2 === ** setang === End of Compilation 3 === ** setdih === End of Compilation 4 === ** rdrest === End of Compilation 5 === ** dihdup === End of Compilation 6 === ** dihpar === End of Compilation 7 === ** setgms === End of Compilation 8 === ** setvar === End of Compilation 9 === ** setnoshake === End of Compilation 10 === 1501-510 Compilation successful for file _set.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dynlib.f > _dynlib.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o dynlib.o _dynlib.f ** corpac === End of Compilation 1 === ** ekcmr === End of Compilation 2 === ** open_dump_files === End of Compilation 3 === ** close_dump_files === End of Compilation 4 === ** prntmd === End of Compilation 5 === ** setvel === End of Compilation 6 === ** mdeng === End of Compilation 7 === ** mden2 === End of Compilation 8 === ** cenmas === End of Compilation 9 === ** stopcm === End of Compilation 10 === "_dynlib.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_dynlib.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_dynlib.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dynlib.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND mdfil.f > _mdfil.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o mdfil.o _mdfil.f ** mdfil === End of Compilation 1 === ** iargc_wrap === End of Compilation 2 === ** getarg_wrap === End of Compilation 3 === 1501-510 Compilation successful for file _mdfil.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND nmlsrc.f > _nmlsrc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o nmlsrc.o _nmlsrc.f ** nmlsrc === End of Compilation 1 === 1501-510 Compilation successful for file _nmlsrc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ew_dipole_recip.f > _ew_dipole_recip.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_dipole_recip.o _ew_dipole_recip.f ** ew_dipole_recip === End of Compilation 1 === "_ew_dipole_recip.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_dipole_recip.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND spatial_dcmp.f > _spatial_dcmp.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o spatial_dcmp.o _spatial_dcmp.f ** spatial === End of Compilation 1 === 1501-510 Compilation successful for file _spatial_dcmp.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND spatial_recip.f > _spatial_recip.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o spatial_recip.o _spatial_recip.f ** ew_recip_spatial === End of Compilation 1 === 1501-510 Compilation successful for file _spatial_recip.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ew_force.f > _ew_force.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_force.o _ew_force.f ** ewald_force === End of Compilation 1 === ** do_pme_recip === End of Compilation 2 === ** force_info === End of Compilation 3 === ** get_nonbond_virial === End of Compilation 4 === ** nb_adjust === End of Compilation 5 === ** nb_adjust_dipole === End of Compilation 6 === ** self === End of Compilation 7 === ** self_dipole === End of Compilation 8 === ** dip_field_corr === End of Compilation 9 === ** respa_scale === End of Compilation 10 === "_ew_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_force.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ew_setup.f > _ew_setup.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_setup.o _ew_setup.f ** assign_ind === End of Compilation 1 === ** check_neutral === End of Compilation 2 === ** init_coulomb_switch === End of Compilation 3 === ** test_prime_factors === End of Compilation 4 === ** check_prime_factors === End of Compilation 5 === ** compute_nfft === End of Compilation 6 === ** cubspl === End of Compilation 7 === ** eed_table_mem === End of Compilation 8 === ** ewald_mem === End of Compilation 9 === ** ew_startup === End of Compilation 10 === ** fill_eed_table === End of Compilation 11 === ** find_ewaldcof === End of Compilation 12 === ** load_adj_mask === End of Compilation 13 === ** load_ewald_info === End of Compilation 14 === ** load_list_mask === End of Compilation 15 === ** loc_nb_mem === End of Compilation 16 === ** print_sz === End of Compilation 17 === ** local_nb_get_sizes === End of Compilation 18 === ** mpole_mem === End of Compilation 19 === ** pme_mem === End of Compilation 20 === ** pmesh_kspace_get_sizes === End of Compilation 21 === ** pmesh_kspace_setup === End of Compilation 22 === ** peek_ewald_inpcrd === End of Compilation 23 === ** read_ewald === End of Compilation 24 === ** vdw_correct_setup === End of Compilation 25 === ** vdw_correction === End of Compilation 26 === ** zero_array === End of Compilation 27 === ** array_copy === End of Compilation 28 === "_ew_setup.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_setup.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_setup.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ew_box.f > _ew_box.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_box.o _ew_box.f ** ew_pscale === End of Compilation 1 === ** dot === End of Compilation 2 === ** cross === End of Compilation 3 === ** fill_ucell === End of Compilation 4 === ** get_ucell === End of Compilation 5 === ** new_ucell_gen === End of Compilation 6 === ** redo_ucell === End of Compilation 7 === ** update_ucell_iso === End of Compilation 8 === ** wrap_molecules === End of Compilation 9 === ** wrap_to === End of Compilation 10 === ** get_position === End of Compilation 11 === ** re_position === End of Compilation 12 === ** nonper_box === End of Compilation 13 === ** firstbox === End of Compilation 14 === "_ew_box.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_box.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_box.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_box.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_box.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_box.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ew_fft.f > _ew_fft.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_fft.o _ew_fft.f ** get_fftdims === End of Compilation 1 === ** fft_backrc === End of Compilation 2 === ** fft_forwardrc === End of Compilation 3 === ** fft_setup === End of Compilation 4 === ** fft3d0rc === End of Compilation 5 === ** fft3d_zxyrc === End of Compilation 6 === ** fft2drc === End of Compilation 7 === ** cfftb === End of Compilation 8 === ** cfftb1 === End of Compilation 9 === ** cfftf === End of Compilation 10 === ** cfftf1 === End of Compilation 11 === ** cffti === End of Compilation 12 === ** cffti1 === End of Compilation 13 === ** passb === End of Compilation 14 === ** passb2 === End of Compilation 15 === ** passb3 === End of Compilation 16 === ** passb4 === End of Compilation 17 === ** passb5 === End of Compilation 18 === ** passf === End of Compilation 19 === ** passf2 === End of Compilation 20 === ** passf3 === End of Compilation 21 === ** passf4 === End of Compilation 22 === ** passf5 === End of Compilation 23 === ** pubz3d === End of Compilation 24 === ** pubz3di === End of Compilation 25 === "_ew_fft.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_fft.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_fft.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_fft.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_fft.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND short_ene.f > _short_ene.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o short_ene.o _short_ene.f ** get_nb_energy === End of Compilation 1 === ** short_ene === End of Compilation 2 === ** short_ene_dip === End of Compilation 3 === "_short_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_short_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _short_ene.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND pcshift.f > _pcshift.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o pcshift.o _pcshift.f ** pcshift === End of Compilation 1 === ** calcresid === End of Compilation 2 === ** ptrir === End of Compilation 3 === ** derivshift === End of Compilation 4 === ** dispshift === End of Compilation 5 === "_pcshift.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_pcshift.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_pcshift.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_pcshift.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _pcshift.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND align.f > _align.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o align.o _align.f ** align1 === End of Compilation 1 === ** alignread === End of Compilation 2 === "_align.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _align.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND rfree.f > _rfree.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o rfree.o _rfree.f ** rfree === End of Compilation 1 === ** ch2int === End of Compilation 2 === 1501-510 Compilation successful for file _rfree.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND rgroup.f > _rgroup.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o rgroup.o _rgroup.f ** rgroup === End of Compilation 1 === ** findrs === End of Compilation 2 === 1501-510 Compilation successful for file _rgroup.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND random.f > _random.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o random.o _random.f ** raset === End of Compilation 1 === ** amrset === End of Compilation 2 === ** amrset_gen === End of Compilation 3 === ** amrand === End of Compilation 4 === ** amrand_gen === End of Compilation 5 === ** gauss === End of Compilation 6 === ** gauss_gen === End of Compilation 7 === "_random.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _random.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND amopen.f > _amopen.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o amopen.o _amopen.f ** amopen === End of Compilation 1 === 1501-510 Compilation successful for file _amopen.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND debug.f > _debug.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o debug.o _debug.f ** debug_mem === End of Compilation 1 === ** load_debug === End of Compilation 2 === ** debug_frc === End of Compilation 3 === ** crd_mod === End of Compilation 4 === ** crd_rst === End of Compilation 5 === ** get_analfrc === End of Compilation 6 === ** fix_xr === End of Compilation 7 === ** get_numfrc === End of Compilation 8 === ** rmsdiff === End of Compilation 9 === ** rms_check === End of Compilation 10 === ** compare === End of Compilation 11 === ** compare_vir === End of Compilation 12 === ** force_dump === End of Compilation 13 === ** check_virial === End of Compilation 14 === ** check_vtens === End of Compilation 15 === ** get_intvir === End of Compilation 16 === ** frc_compare === End of Compilation 17 === ** do_percentiles === End of Compilation 18 === ** save_flow === End of Compilation 19 === ** restore_flow === End of Compilation 20 === ** zero_flow === End of Compilation 21 === ** dump_flow === End of Compilation 22 === "_debug.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_debug.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_debug.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_debug.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _debug.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ew_recip_reg.f > _ew_recip_reg.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_recip_reg.o _ew_recip_reg.f ** recip_reg === End of Compilation 1 === ** do_recip_reg === End of Compilation 2 === ** recip_reg_dipole === End of Compilation 3 === ** do_recip_reg_dipole === End of Compilation 4 === ** maxexp_from_mlim === End of Compilation 5 === ** find_maxexp === End of Compilation 6 === ** get_mlim === End of Compilation 7 === "_ew_recip_reg.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_recip_reg.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_recip_reg.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_recip_reg.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_recip_reg.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ew_handle_dips.f > _ew_handle_dips.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_handle_dips.o _ew_handle_dips.f ** handle_induced === End of Compilation 1 === ** dip_init === End of Compilation 2 === ** dip_iter === End of Compilation 3 === ** dip_fin === End of Compilation 4 === ** get_dipinfo === End of Compilation 5 === ** dipole_stat === End of Compilation 6 === ** get_torque === End of Compilation 7 === ** add_induced === End of Compilation 8 === ** cp_dips === End of Compilation 9 === ** do_cp_dip === End of Compilation 10 === ** get_dips === End of Compilation 11 === ** wrt_dips === End of Compilation 12 === "_ew_handle_dips.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_handle_dips.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_handle_dips.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_handle_dips.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND mexit.f > _mexit.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o mexit.o _mexit.f ** mexit === End of Compilation 1 === 1501-510 Compilation successful for file _mexit.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND new_time.f > _new_time.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o new_time.o _new_time.f ** fill_timer_array === End of Compilation 1 === ** init_timers === End of Compilation 2 === ** add_timer === End of Compilation 3 === ** timer_barrier === End of Compilation 4 === ** timer_start === End of Compilation 5 === ** timer_stop === End of Compilation 6 === ** timer_stop_start === End of Compilation 7 === ** get_level === End of Compilation 8 === ** build_lists === End of Compilation 9 === ** finish_timers === End of Compilation 10 === ** write_timers === End of Compilation 11 === ** write_timerstats === End of Compilation 12 === ** profile_time === End of Compilation 13 === "_new_time.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _new_time.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND extra_pts.f > _extra_pts.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o extra_pts.o _extra_pts.f ** init_extra_pts1 === End of Compilation 1 === ** init_extra_pts === End of Compilation 2 === ** get_nghbrs === End of Compilation 3 === ** define_frames === End of Compilation 4 === ** local_to_global === End of Compilation 5 === ** do_local_global === End of Compilation 6 === ** orient_frc === End of Compilation 7 === ** do_orient_frc === End of Compilation 8 === ** fill_bonded === End of Compilation 9 === ** sort_pairs === End of Compilation 10 === ** redo_masked === End of Compilation 11 === ** add_one_list_iblo === End of Compilation 12 === ** add_one_list_inb === End of Compilation 13 === ** build_14nb === End of Compilation 14 === ** get_14_cg === End of Compilation 15 === ** do_14_cg === End of Compilation 16 === ** get_14_dipole === End of Compilation 17 === ** do_14_dipole === End of Compilation 18 === ** fix_masses === End of Compilation 19 === ** trim_bonds === End of Compilation 20 === ** trim_theta === End of Compilation 21 === ** trim_phi === End of Compilation 22 === ** fix_degree_count === End of Compilation 23 === ** allocate_14nb === End of Compilation 24 === ** copy_14nb === End of Compilation 25 === ** allocate_frames === End of Compilation 26 === ** do_pairs === End of Compilation 27 === ** do_14pairs === End of Compilation 28 === "_extra_pts.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_extra_pts.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_extra_pts.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _extra_pts.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND thermo_int.f > _thermo_int.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o thermo_int.o _thermo_int.f ** mix_frcti === End of Compilation 1 === ** mix_evb === End of Compilation 2 === ** combination === End of Compilation 3 === ** factorial === End of Compilation 4 === ** func_new === End of Compilation 5 === 1501-510 Compilation successful for file _thermo_int.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND matinv.f > _matinv.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o matinv.o _matinv.f ** matinv === End of Compilation 1 === 1501-510 Compilation successful for file _matinv.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND assert.f > _assert.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o assert.o _assert.f ** aass === End of Compilation 1 === 1501-510 Compilation successful for file _assert.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND mmtsb.f > _mmtsb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o mmtsb.o _mmtsb.f ** mmtsb_init === End of Compilation 1 === ** mmtsb_print_banner === End of Compilation 2 === 1501-510 Compilation successful for file _mmtsb.f. xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o mmtsb_client.o mmtsb_client.c xlc: 1501-216 command option -0 is not recognized - passed to ld /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND erfcfun.f > _erfcfun.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o erfcfun.o _erfcfun.f ** erfcfun === End of Compilation 1 === ** get_ee_func === End of Compilation 2 === "_erfcfun.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_erfcfun.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _erfcfun.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND veclib.f > _veclib.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o veclib.o _veclib.f ** vdexp === End of Compilation 1 === ** vdln === End of Compilation 2 === ** vdinvsqrt === End of Compilation 3 === ** vdinv === End of Compilation 4 === ** vdcos === End of Compilation 5 === ** vdtanh === End of Compilation 6 === 1501-510 Compilation successful for file _veclib.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND is_init.f > _is_init.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o is_init.o _is_init.f ** pb_read === End of Compilation 1 === ** pb_print === End of Compilation 2 === ** pb_free === End of Compilation 3 === ** pb_init === End of Compilation 4 === ** blkgreen === End of Compilation 5 === 1501-510 Compilation successful for file _is_init.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND constantph.f > _constantph.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o constantph.o _constantph.f ** cnstphinit === End of Compilation 1 === ** cnstphupdatepairs === End of Compilation 2 === ** cnstphbeginstep === End of Compilation 3 === ** cnstphendstep === End of Compilation 4 === ** cnstphupdatechrg === End of Compilation 5 === ** cnstphwriterestart === End of Compilation 6 === ** cnstphwrite === End of Compilation 7 === "_constantph.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _constantph.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND prn_dipoles.f > _prn_dipoles.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o prn_dipoles.o _prn_dipoles.f ** printdip === End of Compilation 1 === ** calc_grp_centre_of_mass === End of Compilation 2 === 1501-510 Compilation successful for file _prn_dipoles.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ips.f > _ips.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ips.o _ips.f ** ipssys === End of Compilation 1 === ** ipsupdate === End of Compilation 2 === ** eexips === End of Compilation 3 === 1501-510 Compilation successful for file _ips.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sglds.f > _sglds.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o sglds.o _sglds.f ** psgld === End of Compilation 1 === ** sgldw === End of Compilation 2 === ** sgmdw === End of Compilation 3 === "_sglds.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_sglds.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _sglds.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm_mm.f > _qm_mm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_mm.o _qm_mm.f ** qm_mm === End of Compilation 1 === ** qm_get_boundbox === End of Compilation 2 === ** qm_check_periodic === End of Compilation 3 === ** qm_fill_qm_xcrd === End of Compilation 4 === ** qm_fill_qm_xcrd_periodic === End of Compilation 5 === "_qm_mm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm_mm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm_mm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm_mm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm_link_atoms.f > _qm_link_atoms.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_link_atoms.o _qm_link_atoms.f ** identify_link_atoms === End of Compilation 1 === ** position_link_atoms === End of Compilation 2 === ** distribute_lnk_f === End of Compilation 3 === ** print_link_atom_info === End of Compilation 4 === ** adj_mm_link_pair_crd === End of Compilation 5 === ** rst_mm_link_pair_crd === End of Compilation 6 === ** qmsort_link_pairs === End of Compilation 7 === 1501-510 Compilation successful for file _qm_link_atoms.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm_nb_list.f > _qm_nb_list.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_nb_list.o _qm_nb_list.f ** qm_nb_list_allqm === End of Compilation 1 === 1501-510 Compilation successful for file _qm_nb_list.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm_extract_coords.f > _qm_extract_coords.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_extract_coords.o _qm_extract_coords.f ** qm_extract_coords === End of Compilation 1 === 1501-510 Compilation successful for file _qm_extract_coords.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm_ewald.f > _qm_ewald.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_ewald.o _qm_ewald.f ** allocate_qmewald === End of Compilation 1 === ** qm_ewald_setup === End of Compilation 2 === ** qm_ewald_calc_kvec === End of Compilation 3 === ** qm_ewald_calc_ktable === End of Compilation 4 === ** qm_ewald_mm_pot === End of Compilation 5 === ** qm_ewald_qm_pot === End of Compilation 6 === ** qm_ewald_add_fock === End of Compilation 7 === ** qm_ewald_correct_ee === End of Compilation 8 === ** qm_ewald_core === End of Compilation 9 === ** qm_ewald_get_forces === End of Compilation 10 === "_qm_ewald.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm_ewald.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm_ewald.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm_ewald.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm_ewald.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm_ewald.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm_gb.f > _qm_gb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_gb.o _qm_gb.f ** allocate_qmgb === End of Compilation 1 === ** qmgb_calc_qmqm_onefij === End of Compilation 2 === ** qmgb_calc_mm_pot === End of Compilation 3 === ** qmgb_calc_qm_pot === End of Compilation 4 === ** qmgb_add_fock === End of Compilation 5 === "_qm_gb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm_gb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm_gb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm_gb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm_zero_charges.f > _qm_zero_charges.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_zero_charges.o _qm_zero_charges.f ** qm_zero_charges === End of Compilation 1 === ** qm_zero_mm_link_pair_main_chg === End of Compilation 2 === ** qmmm_adjust_q === End of Compilation 3 === "_qm_zero_charges.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm_zero_charges.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm_print_info.f > _qm_print_info.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_print_info.o _qm_print_info.f ** qm_print_coords === End of Compilation 1 === ** qm_write_pdb === End of Compilation 2 === ** qm_print_dyn_mem === End of Compilation 3 === ** qm_print_ref === End of Compilation 4 === 1501-510 Compilation successful for file _qm_print_info.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm_assign_atom_types.f > _qm_assign_atom_types.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_assign_atom_types.o _qm_assign_atom_types.f ** qm_assign_atom_types === End of Compilation 1 === 1501-510 Compilation successful for file _qm_assign_atom_types.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_allocate_e_repul.f > _qm2_allocate_e_repul.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_allocate_e_repul.o _qm2_allocate_e_repul.f ** qm2_allocate_qmqm_e_repul === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_allocate_e_repul.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_calc_charges.f > _qm2_calc_charges.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_calc_charges.o _qm2_calc_charges.f ** qm2_calc_mulliken === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_calc_charges.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_calc_rij_and_eqns.f > _qm2_calc_rij_and_eqns.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_calc_rij_and_eqns.o _qm2_calc_rij_and_eqns.f ** qm2_calc_rij_and_eqns === End of Compilation 1 === ** qm2_allocate_qm2_qmqm_rij_eqns === End of Compilation 2 === ** qm2_allocate_qm2_qmmm_rij_eqns === End of Compilation 3 === 1501-510 Compilation successful for file _qm2_calc_rij_and_eqns.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dihed.f > _qm2_dihed.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dihed.o _qm2_dihed.f ** qm2_dihed === End of Compilation 1 === ** qm2_dang === End of Compilation 2 === "_qm2_dihed.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dihed.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dihed.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_energy.f > _qm2_energy.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_energy.o _qm2_energy.f ** qm2_energy === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_energy.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_fock.f > _qm2_fock.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_fock.o _qm2_fock.f ** qm2_fock1 === End of Compilation 1 === ** qm2_fock2 === End of Compilation 2 === ** qm2_jab === End of Compilation 3 === ** qm2_kab === End of Compilation 4 === "_qm2_fock.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_fock.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_get_qm_forces.f > _qm2_get_qm_forces.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_get_qm_forces.o _qm2_get_qm_forces.f ** qm2_get_qm_forces === End of Compilation 1 === ** qm2_deriv_qm_analyt === End of Compilation 2 === "_qm2_get_qm_forces.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_get_qm_forces.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_get_qmmm_forces.f > _qm2_get_qmmm_forces.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_get_qmmm_forces.o _qm2_get_qmmm_forces.f ** qm2_get_qmmm_forces === End of Compilation 1 === ** qm2_deriv_qmmm_light === End of Compilation 2 === ** qm2_deriv_qmmm_heavy === End of Compilation 3 === "_qm2_get_qmmm_forces.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_get_qmmm_forces.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_h1elec.f > _qm2_h1elec.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_h1elec.o _qm2_h1elec.f ** qm2_h1elec === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_h1elec.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_hcore_qmqm.f > _qm2_hcore_qmqm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_hcore_qmqm.o _qm2_hcore_qmqm.f ** qm2_hcore_qmqm === End of Compilation 1 === "_qm2_hcore_qmqm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_hcore_qmqm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_hcore_qmmm.f > _qm2_hcore_qmmm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_hcore_qmmm.o _qm2_hcore_qmmm.f ** qm2_hcore_qmmm === End of Compilation 1 === ** qm2_rotate_qmmm_light === End of Compilation 2 === ** qm2_rotate_qmmm_heavy === End of Compilation 3 === "_qm2_hcore_qmmm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_hcore_qmmm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_hcore_qmmm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_identify_peptide_links.f > _qm2_identify_peptide_links.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_identify_peptide_links.o _qm2_identify_peptide_links.f ** qm2_identify_peptide_links === End of Compilation 1 === "_qm2_identify_peptide_links.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_identify_peptide_links.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_load_params_and_allocate.f > _qm2_load_params_and_allocate.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o qm2_load_params_and_allocate.o _qm2_load_params_and_allocate.f "_qm2_load_params_and_allocate.f", line 3539.24: 1512-050 (W) Field separator is missing, in literal FMT specifier, after edit descriptor '. A comma is assumed. ** qm2_load_params_and_allocate === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_load_params_and_allocate.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_repp.f > _qm2_repp.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_repp.o _qm2_repp.f ** qm2_repp === End of Compilation 1 === "_qm2_repp.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_repp.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_rotate_qmqm.f > _qm2_rotate_qmqm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_rotate_qmqm.o _qm2_rotate_qmqm.f ** qm2_rotate_qmqm === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_rotate_qmqm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_scf.f > _qm2_scf.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_scf.o _qm2_scf.f ** qm2_scf === End of Compilation 1 === ** qm2_densit === End of Compilation 2 === ** qm2_cnvg === End of Compilation 3 === ** qm2_mat_diag === End of Compilation 4 === ** qm2_pseudo_diag === End of Compilation 5 === ** qm2_helect === End of Compilation 6 === "_qm2_scf.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_scf.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_scf.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_scf.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_scf.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_scf.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_setup_orb_exp.f > _qm2_setup_orb_exp.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_setup_orb_exp.o _qm2_setup_orb_exp.f ** qm2_setup_orb_exp === End of Compilation 1 === "_qm2_setup_orb_exp.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_setup_orb_exp.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_smallest_number.f > _qm2_smallest_number.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o qm2_smallest_number.o _qm2_smallest_number.f ** qm2_smallest_number === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_smallest_number.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_module.f > _qm2_dftb_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o qm2_dftb_module.o _qm2_dftb_module.f ** qm2_dftb_module === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_dftb_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_broyden.f > _qm2_dftb_broyden.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_broyden.o _qm2_dftb_broyden.f ** broyden === End of Compilation 1 === ** inverse === End of Compilation 2 === 1501-510 Compilation successful for file _qm2_dftb_broyden.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_dispersion_egr.f > _qm2_dftb_dispersion_egr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_dispersion_egr.o _qm2_dftb_dispersion_egr.f ** dispersion_egr === End of Compilation 1 === ** dis_e === End of Compilation 2 === ** dis_gr === End of Compilation 3 === "_qm2_dftb_dispersion_egr.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dftb_dispersion_egr.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dftb_dispersion_egr.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_dispersion_egr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_dispersion_params.f > _qm2_dftb_dispersion_params.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_dispersion_params.o _qm2_dftb_dispersion_params.f ** dispersion_params === End of Compilation 1 === "_qm2_dftb_dispersion_params.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_dispersion_params.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_dispersionread.f > _qm2_dftb_dispersionread.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_dispersionread.o _qm2_dftb_dispersionread.f ** dispersionread === End of Compilation 1 === "_qm2_dftb_dispersionread.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_dispersionread.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_eglcao.f > _qm2_dftb_eglcao.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_eglcao.o _qm2_dftb_eglcao.f ** eglcao === End of Compilation 1 === ** qm2_dftb_ewald_corr === End of Compilation 2 === 1501-510 Compilation successful for file _qm2_dftb_eglcao.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_energy.f > _qm2_dftb_energy.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_energy.o _qm2_dftb_energy.f ** qm2_dftb_energy === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_dftb_energy.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_ewevge.f > _qm2_dftb_ewevge.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o qm2_dftb_ewevge.o _qm2_dftb_ewevge.f ** ewevge === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_dftb_ewevge.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_externalchgrad.f > _qm2_dftb_externalchgrad.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_externalchgrad.o _qm2_dftb_externalchgrad.f ** externalchgrad === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_dftb_externalchgrad.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_externalshift.f > _qm2_dftb_externalshift.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_externalshift.o _qm2_dftb_externalshift.f ** externalshift === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_dftb_externalshift.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_fermi.f > _qm2_dftb_fermi.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_fermi.o _qm2_dftb_fermi.f ** fermi === End of Compilation 1 === "_qm2_dftb_fermi.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_fermi.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_forces.f > _qm2_dftb_forces.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_forces.o _qm2_dftb_forces.f ** qm2_dftb_forces === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_dftb_forces.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_gamma.f > _qm2_dftb_gamma.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_gamma.o _qm2_dftb_gamma.f ** gam12 === End of Compilation 1 === ** gam121 === End of Compilation 2 === ** gamsub === End of Compilation 3 === "_qm2_dftb_gamma.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dftb_gamma.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dftb_gamma.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_gamma.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_gammamat.f > _qm2_dftb_gammamat.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_gammamat.o _qm2_dftb_gammamat.f ** gammamatrix === End of Compilation 1 === ** gammamatrix1 === End of Compilation 2 === 1501-510 Compilation successful for file _qm2_dftb_gammamat.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_get_qmmm_forces.f > _qm2_dftb_get_qmmm_forces.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_get_qmmm_forces.o _qm2_dftb_get_qmmm_forces.f ** qm2_dftb_get_qmmm_forces === End of Compilation 1 === "_qm2_dftb_get_qmmm_forces.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_get_qmmm_forces.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_gettab.f > _qm2_dftb_gettab.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_gettab.o _qm2_dftb_gettab.f ** gettab === End of Compilation 1 === 1501-510 Compilation successful for file _qm2_dftb_gettab.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_load_params.f > _qm2_dftb_load_params.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_load_params.o _qm2_dftb_load_params.f ** qm2_dftb_load_params === End of Compilation 1 === ** qm2_dftb_check_slko_file === End of Compilation 2 === ** qm2_dftb_allocate === End of Compilation 3 === ** qm2_dftb_deallocate === End of Compilation 4 === "_qm2_dftb_load_params.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_load_params.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_long_range.f > _qm2_dftb_long_range.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_long_range.o _qm2_dftb_long_range.f ** initphi === End of Compilation 1 === ** phi === End of Compilation 2 === ** phi1 === End of Compilation 3 === ** cross_prod === End of Compilation 4 === ** rezvol === End of Compilation 5 === ** terfc === End of Compilation 6 === ** getalpha === End of Compilation 7 === ** getgrmax === End of Compilation 8 === ** diffrecreal === End of Compilation 9 === ** gspace === End of Compilation 10 === ** rspace === End of Compilation 11 === "_qm2_dftb_long_range.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dftb_long_range.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dftb_long_range.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_long_range.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_main.f > _qm2_dftb_main.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_main.o _qm2_dftb_main.f "_qm2_dftb_main.f", line 175.62: 1512-050 (W) Field separator is missing, in literal FMT specifier, after edit descriptor X. A comma is assumed. ** qm2_dftb_main === End of Compilation 1 === ** qm2_dftb_dylcao === End of Compilation 2 === ** qm2_dftb_reallocate_nextch === End of Compilation 3 === 1501-510 Compilation successful for file _qm2_dftb_main.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_my_gradient.f > _qm2_dftb_my_gradient.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_my_gradient.o _qm2_dftb_my_gradient.f ** usualgrd === End of Compilation 1 === "_qm2_dftb_my_gradient.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_my_gradient.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_my_mulliken.f > _qm2_dftb_my_mulliken.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_my_mulliken.o _qm2_dftb_my_mulliken.f ** mulliken === End of Compilation 1 === "_qm2_dftb_my_mulliken.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_my_mulliken.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_repulsiv.f > _qm2_dftb_repulsiv.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_repulsiv.o _qm2_dftb_repulsiv.f ** repulsive === End of Compilation 1 === ** repulsivegrd === End of Compilation 2 === ** repen === End of Compilation 3 === ** grdrep === End of Compilation 4 === "_qm2_dftb_repulsiv.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dftb_repulsiv.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dftb_repulsiv.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_repulsiv.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_self.f > _qm2_dftb_self.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_self.o _qm2_dftb_self.f ** selfs === End of Compilation 1 === ** selfp === End of Compilation 2 === ** selfd === End of Compilation 3 === 1501-510 Compilation successful for file _qm2_dftb_self.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_shift.f > _qm2_dftb_shift.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_shift.o _qm2_dftb_shift.f ** hamilshift === End of Compilation 1 === ** gammagrad === End of Compilation 2 === "_qm2_dftb_shift.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_shift.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_short_range.f > _qm2_dftb_short_range.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_short_range.o _qm2_dftb_short_range.f ** shortrange === End of Compilation 1 === ** shortrange1 === End of Compilation 2 === "_qm2_dftb_short_range.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dftb_short_range.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_short_range.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_skpar.f > _qm2_dftb_skpar.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_skpar.o _qm2_dftb_skpar.f ** skspar === End of Compilation 1 === ** skhpar === End of Compilation 2 === ** cubicspline === End of Compilation 3 === ** spline5th === End of Compilation 4 === "_qm2_dftb_skpar.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dftb_skpar.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dftb_skpar.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_skpar.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_slkode.f > _qm2_dftb_slkode.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_slkode.o _qm2_dftb_slkode.f ** slkmatrices === End of Compilation 1 === ** slkode === End of Compilation 2 === "_qm2_dftb_slkode.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_slkode.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm2_dftb_slktrafo.f > _qm2_dftb_slktrafo.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm2_dftb_slktrafo.o _qm2_dftb_slktrafo.f ** skss === End of Compilation 1 === ** sksp === End of Compilation 2 === ** sksd === End of Compilation 3 === ** skpp === End of Compilation 4 === ** skpd === End of Compilation 5 === ** skdd === End of Compilation 6 === "_qm2_dftb_slktrafo.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm2_dftb_slktrafo.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm2_dftb_slktrafo.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND qm_div.f > _qm_div.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_div.o _qm_div.f ** qm_div === End of Compilation 1 === 1501-510 Compilation successful for file _qm_div.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND force.f > _force.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o force.o _force.f ** force === End of Compilation 1 === ** evb_amber_alloc === End of Compilation 2 === ** evb_amber_dealloc === End of Compilation 3 === "_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _force.f. cd ../lib; make sys.a /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sys.f > _sys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -o sys.o _sys.f ** amflsh === End of Compilation 1 === 1501-510 Compilation successful for file _sys.f. xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o wallclock.o wallclock.c xlc: 1501-216 command option -0 is not recognized - passed to ld ar rvs sys.a sys.o wallclock.o ar: creating archive sys.a a - sys.o a - wallclock.o ranlib sys.a cd ../lib; make nxtsec.o make[2]: `nxtsec.o' is up to date. cd ../lapack; make Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND xerbla.f > _xerbla.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o xerbla.o _xerbla.f ** xerbla === End of Compilation 1 === 1501-510 Compilation successful for file _xerbla.f. ar rvs lapack.a xerbla.o ar: creating archive lapack.a a - xerbla.o ranlib lapack.a cd ../blas; make Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dummy.f > _dummy.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dummy.o _dummy.f ** dummyblas === End of Compilation 1 === 1501-510 Compilation successful for file _dummy.f. ar rvs blas.a dummy.o ar: creating archive blas.a a - dummy.o ranlib blas.a cd ../lmod; make cd xmin; make Makefile:6: warning: overriding commands for target `.f.o' ../../config.h:82: warning: ignoring old commands for target `.f.o' /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND xmin.f > _xmin.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o xmin.o _xmin.f ** xmin === End of Compilation 1 === 1501-510 Compilation successful for file _xmin.f. cd lmod; make Makefile:6: warning: overriding commands for target `.f.o' ../../config.h:82: warning: ignoring old commands for target `.f.o' /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND lmod.f > _lmod.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o lmod.o _lmod.f ** lmod === End of Compilation 1 === 1501-510 Compilation successful for file _lmod.f. ar rvs lmod.a xmin/*.o lmod/*.o ar: creating archive lmod.a a - xmin/xmin.o a - lmod/lmod.o ranlib lmod.a cd ../lmod; cp lmodprmtop ../../exe; chmod 0755 ../../exe/lmodprmtop cd ../dcqtp; make libdivcon.a cd mod; make libdivcon.a /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/param/param_module.F90 > ../obj/param_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/param_module.o ../obj/param_module.f ** param_module === End of Compilation 1 === 1501-510 Compilation successful for file param_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/math/math_module.F90 > ../obj/math_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/math_module.o ../obj/math_module.f ** math_module === End of Compilation 1 === 1501-510 Compilation successful for file math_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mm/mm_module.F90 > ../obj/mm_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mm_module.o ../obj/mm_module.f ** mm_module === End of Compilation 1 === 1501-510 Compilation successful for file mm_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/error_module.F90 > ../obj/error_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/error_module.o ../obj/error_module.f ** error_module === End of Compilation 1 === 1501-510 Compilation successful for file error_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_module.F90 > ../obj/pme_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_module.o ../obj/pme_module.f ** pme_module === End of Compilation 1 === 1501-510 Compilation successful for file pme_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/nmr/nmr_module.F90 > ../obj/nmr_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/nmr_module.o ../obj/nmr_module.f ** nmr_module === End of Compilation 1 === 1501-510 Compilation successful for file nmr_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/dc_module.F90 > ../obj/dc_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dc_module.o ../obj/dc_module.f ** dc_module === End of Compilation 1 === 1501-510 Compilation successful for file dc_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/freq/freq_module.F90 > ../obj/freq_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/freq_module.o ../obj/freq_module.f ** freq_module === End of Compilation 1 === 1501-510 Compilation successful for file freq_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ham/mndod_module.F90 > ../obj/mndod_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mndod_module.o ../obj/mndod_module.f ** mndod_module === End of Compilation 1 === 1501-510 Compilation successful for file mndod_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ham/pddgpm3_module.F90 > ../obj/pddgpm3_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pddgpm3_module.o ../obj/pddgpm3_module.f ** pddgpm3_module === End of Compilation 1 === 1501-510 Compilation successful for file pddgpm3_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/int_module.F90 > ../obj/int_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/int_module.o ../obj/int_module.f ** int_module === End of Compilation 1 === 1501-510 Compilation successful for file int_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/mc_module.F90 > ../obj/mc_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mc_module.o ../obj/mc_module.f ** mc_module === End of Compilation 1 === 1501-510 Compilation successful for file mc_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/tools_module.F90 > ../obj/tools_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/tools_module.o ../obj/tools_module.f ** tools_module === End of Compilation 1 === 1501-510 Compilation successful for file tools_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ts/ts_module.F90 > ../obj/ts_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/ts_module.o ../obj/ts_module.f ** ts_module === End of Compilation 1 === 1501-510 Compilation successful for file ts_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/scf/scf_module.F90 > ../obj/scf_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/scf_module.o ../obj/scf_module.f ** scf_module === End of Compilation 1 === 1501-510 Compilation successful for file scf_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/nmr/mndonmr_module.F90 > ../obj/mndonmr_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mndonmr_module.o ../obj/mndonmr_module.f ** mndonmr_module === End of Compilation 1 === 1501-510 Compilation successful for file mndonmr_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/min/min_module.F90 > ../obj/min_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/min_module.o ../obj/min_module.f ** min_module === End of Compilation 1 === 1501-510 Compilation successful for file min_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/element_module.F90 > ../obj/element_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/element_module.o ../obj/element_module.f ** element_module === End of Compilation 1 === 1501-510 Compilation successful for file element_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/global_module.F90 > ../obj/global_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/global_module.o ../obj/global_module.f ** global_module === End of Compilation 1 === 1501-510 Compilation successful for file global_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/chg/chgRdKeys.F90 > ../obj/chgRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/chgRdKeys.o ../obj/chgRdKeys.f ** chgrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file chgRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/ioRdKeys.F90 > ../obj/ioRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/ioRdKeys.o ../obj/ioRdKeys.f ** iordkeys === End of Compilation 1 === 1501-510 Compilation successful for file ioRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/ioRdTail.F90 > ../obj/ioRdTail.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/ioRdTail.o ../obj/ioRdTail.f ** iordtail === End of Compilation 1 === 1501-510 Compilation successful for file ioRdTail.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/dcRdKeys.F90 > ../obj/dcRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dcRdKeys.o ../obj/dcRdKeys.f ** dcrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file dcRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/dcRdTail.F90 > ../obj/dcRdTail.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dcRdTail.o ../obj/dcRdTail.f ** dcrdtail === End of Compilation 1 === 1501-510 Compilation successful for file dcRdTail.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/mcRdKeys.F90 > ../obj/mcRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mcRdKeys.o ../obj/mcRdKeys.f ** mcrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file mcRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/min/minRdKeys.F90 > ../obj/minRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/minRdKeys.o ../obj/minRdKeys.f ** minrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file minRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/min/minRdTail.F90 > ../obj/minRdTail.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/minRdTail.o ../obj/minRdTail.f ** minrdtail === End of Compilation 1 === 1501-510 Compilation successful for file minRdTail.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mm/mmRdKeys.F90 > ../obj/mmRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mmRdKeys.o ../obj/mmRdKeys.f ** mmrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file mmRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mm/mmRdTail.F90 > ../obj/mmRdTail.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mmRdTail.o ../obj/mmRdTail.f ** mmrdtail === End of Compilation 1 === 1501-510 Compilation successful for file mmRdTail.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/nmr/nmrRdKeys.F90 > ../obj/nmrRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/nmrRdKeys.o ../obj/nmrRdKeys.f ** nmrrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file nmrRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/nmr/nmrRdTail.F90 > ../obj/nmrRdTail.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/nmrRdTail.o ../obj/nmrRdTail.f ** nmrrdtail === End of Compilation 1 === 1501-510 Compilation successful for file nmrRdTail.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/param/paramRdKeys.F90 > ../obj/paramRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/paramRdKeys.o ../obj/paramRdKeys.f ** paramrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file paramRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpmodule.F90 > ../obj/dpmodule.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpmodule.o ../obj/dpmodule.f ** divpb_interface === End of Compilation 1 === ** divpb_private === End of Compilation 2 === 1501-510 Compilation successful for file dpmodule.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/pbRdKeys.F90 > ../obj/pbRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pbRdKeys.o ../obj/pbRdKeys.f ** pbrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file pbRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pmeRdKeys.F90 > ../obj/pmeRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pmeRdKeys.o ../obj/pmeRdKeys.f ** pmerdkeys === End of Compilation 1 === 1501-510 Compilation successful for file pmeRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/scf/scfRdKeys.F90 > ../obj/scfRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/scfRdKeys.o ../obj/scfRdKeys.f ** scfrdkeys === End of Compilation 1 === "../obj/scfRdKeys.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file scfRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ts/tsRdKeys.F90 > ../obj/tsRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/tsRdKeys.o ../obj/tsRdKeys.f ** tsrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file tsRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/atgrid.F90 > ../obj/atgrid.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/atgrid.o ../obj/atgrid.f ** atgrid === End of Compilation 1 === 1501-510 Compilation successful for file atgrid.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/chkres.F90 > ../obj/chkres.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/chkres.o ../obj/chkres.f ** chkres === End of Compilation 1 === 1501-510 Compilation successful for file chkres.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/clustsub.F90 > ../obj/clustsub.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/clustsub.o ../obj/clustsub.f ** clustsub === End of Compilation 1 === "../obj/clustsub.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file clustsub.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/cmbcore.F90 > ../obj/cmbcore.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/cmbcore.o ../obj/cmbcore.f ** cmbcore === End of Compilation 1 === 1501-510 Compilation successful for file cmbcore.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/cmbsub.F90 > ../obj/cmbsub.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/cmbsub.o ../obj/cmbsub.f ** cmbsub === End of Compilation 1 === 1501-510 Compilation successful for file cmbsub.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/doferm.F90 > ../obj/doferm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/doferm.o ../obj/doferm.f ** doferm === End of Compilation 1 === "../obj/doferm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file doferm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/esqr.F90 > ../obj/esqr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/esqr.o ../obj/esqr.f ** esqr === End of Compilation 1 === "../obj/esqr.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file esqr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/esqrfdm.F90 > ../obj/esqrfdm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/esqrfdm.o ../obj/esqrfdm.f ** esqrfdm === End of Compilation 1 === 1501-510 Compilation successful for file esqrfdm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/save_module.F90 > ../obj/save_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/save_module.o ../obj/save_module.f ** save_module === End of Compilation 1 === 1501-510 Compilation successful for file save_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/frmchk.F90 > ../obj/frmchk.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/frmchk.o ../obj/frmchk.f ** frmchk === End of Compilation 1 === 1501-510 Compilation successful for file frmchk.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/fshift.F90 > ../obj/fshift.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/fshift.o ../obj/fshift.f ** fshift === End of Compilation 1 === 1501-510 Compilation successful for file fshift.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/gensub.F90 > ../obj/gensub.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/gensub.o ../obj/gensub.f ** gensub === End of Compilation 1 === 1501-510 Compilation successful for file gensub.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/gridafnc.F90 > ../obj/gridafnc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/gridafnc.o ../obj/gridafnc.f ** getacorners === End of Compilation 1 === ** getaribs === End of Compilation 2 === ** getaplanes === End of Compilation 3 === ** getacore === End of Compilation 4 === ** getaat === End of Compilation 5 === ** getainner === End of Compilation 6 === 1501-510 Compilation successful for file gridafnc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/gridrfnc.F90 > ../obj/gridrfnc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/gridrfnc.o ../obj/gridrfnc.f ** getrcorners === End of Compilation 1 === ** getrribs === End of Compilation 2 === ** getrplanes === End of Compilation 3 === ** getrcore === End of Compilation 4 === ** getrat === End of Compilation 5 === ** getrinner === End of Compilation 6 === 1501-510 Compilation successful for file gridrfnc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/mixgrid.F90 > ../obj/mixgrid.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mixgrid.o ../obj/mixgrid.f ** mixgrid === End of Compilation 1 === 1501-510 Compilation successful for file mixgrid.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/mkgrid.F90 > ../obj/mkgrid.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mkgrid.o ../obj/mkgrid.f ** mkrgrid === End of Compilation 1 === ** mkagrid === End of Compilation 2 === 1501-510 Compilation successful for file mkgrid.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/pgridafnc.F90 > ../obj/pgridafnc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pgridafnc.o ../obj/pgridafnc.f ** pgetacorners === End of Compilation 1 === ** pgetaribs === End of Compilation 2 === ** pgetaplanes === End of Compilation 3 === ** pgetacore === End of Compilation 4 === ** pgetaat === End of Compilation 5 === ** pgetainner === End of Compilation 6 === 1501-510 Compilation successful for file pgridafnc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/pgridrfnc.F90 > ../obj/pgridrfnc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pgridrfnc.o ../obj/pgridrfnc.f ** pgetrcorners === End of Compilation 1 === ** pgetrribs === End of Compilation 2 === ** pgetrplanes === End of Compilation 3 === ** pgetrcore === End of Compilation 4 === ** pgetrat === End of Compilation 5 === ** pgetrinner === End of Compilation 6 === 1501-510 Compilation successful for file pgridrfnc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/resgrid.F90 > ../obj/resgrid.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/resgrid.o ../obj/resgrid.f ** resgrid === End of Compilation 1 === 1501-510 Compilation successful for file resgrid.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/setncell.F90 > ../obj/setncell.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/setncell.o ../obj/setncell.f ** setncell === End of Compilation 1 === "../obj/setncell.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file setncell.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/dc/sproc.F90 > ../obj/sproc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/sproc.o ../obj/sproc.f ** sproc1 === End of Compilation 1 === ** sproc2 === End of Compilation 2 === 1501-510 Compilation successful for file sproc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/freq/freq.F90 > ../obj/freq.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/freq.o ../obj/freq.f ** freq === End of Compilation 1 === ** matsym === End of Compilation 2 === "../obj/freq.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file freq.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/freq/hsep.F90 > ../obj/hsep.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/hsep.o ../obj/hsep.f ** hsep === End of Compilation 1 === 1501-510 Compilation successful for file hsep.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/freq/freqRdKeys.F90 > ../obj/freqRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/freqRdKeys.o ../obj/freqRdKeys.f ** freqrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file freqRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/freq/freqRdTail.F90 > ../obj/freqRdTail.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/freqRdTail.o ../obj/freqRdTail.f ** freqrdtail === End of Compilation 1 === 1501-510 Compilation successful for file freqRdTail.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ham/hamRdKeys.F90 > ../obj/hamRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/hamRdKeys.o ../obj/hamRdKeys.f ** hamrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file hamRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ham/mndo_module.F90 > ../obj/mndo_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mndo_module.o ../obj/mndo_module.f ** initialize_mndovars === End of Compilation 1 === 1501-510 Compilation successful for file mndo_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ham/am1_module.F90 > ../obj/am1_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/am1_module.o ../obj/am1_module.f ** initialize_am1vars === End of Compilation 1 === 1501-510 Compilation successful for file am1_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ham/pm3_module.F90 > ../obj/pm3_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pm3_module.o ../obj/pm3_module.f ** initialize_pm3vars === End of Compilation 1 === 1501-510 Compilation successful for file pm3_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/aijm.F90 > ../obj/aijm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/aijm.o ../obj/aijm.f ** aijm === End of Compilation 1 === ** aijl === End of Compilation 2 === 1501-510 Compilation successful for file aijm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/attrecurse.F90 > ../obj/attrecurse.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/attrecurse.o ../obj/attrecurse.f ** attrecurse === End of Compilation 1 === "../obj/attrecurse.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file attrecurse.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/ddpo.F90 > ../obj/ddpo.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/ddpo.o ../obj/ddpo.f ** ddpo === End of Compilation 1 === ** poij === End of Compilation 2 === "../obj/ddpo.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file ddpo.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/diat.F90 > ../obj/diat.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/diat.o ../obj/diat.f ** diat === End of Compilation 1 === 1501-510 Compilation successful for file diat.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/ecd.F90 > ../obj/ecd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/ecd.o ../obj/ecd.f ** ecda === End of Compilation 1 === ** ecdb === End of Compilation 2 === 1501-510 Compilation successful for file ecd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/electricfield.F90 > ../obj/electricfield.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/electricfield.o ../obj/electricfield.f ** electricfld === End of Compilation 1 === 1501-510 Compilation successful for file electricfield.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/erecursive.F90 > ../obj/erecursive.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/erecursive.o ../obj/erecursive.f ** elctfldrecurse === End of Compilation 1 === "../obj/erecursive.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file erecursive.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/FmT.F90 > ../obj/FmT.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/FmT.o ../obj/FmT.f ** fmt === End of Compilation 1 === 1501-510 Compilation successful for file FmT.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/inighd.F90 > ../obj/inighd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/inighd.o ../obj/inighd.f ** inighd === End of Compilation 1 === ** scprm === End of Compilation 2 === ** rsc === End of Compilation 3 === ** xlogfac === End of Compilation 4 === "../obj/inighd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file inighd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/intdd1.F90 > ../obj/intdd1.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intdd1.o ../obj/intdd1.f ** intdd1 === End of Compilation 1 === 1501-510 Compilation successful for file intdd1.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/intdd2.F90 > ../obj/intdd2.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intdd2.o ../obj/intdd2.f ** intdd2 === End of Compilation 1 === 1501-510 Compilation successful for file intdd2.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/intdd3.F90 > ../obj/intdd3.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intdd3.o ../obj/intdd3.f ** intdd3 === End of Compilation 1 === 1501-510 Compilation successful for file intdd3.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/intdd4.F90 > ../obj/intdd4.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intdd4.o ../obj/intdd4.f ** intdd4 === End of Compilation 1 === 1501-510 Compilation successful for file intdd4.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/intdd5.F90 > ../obj/intdd5.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intdd5.o ../obj/intdd5.f ** intdd5 === End of Compilation 1 === 1501-510 Compilation successful for file intdd5.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/intdd6.F90 > ../obj/intdd6.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intdd6.o ../obj/intdd6.f ** intdd6 === End of Compilation 1 === 1501-510 Compilation successful for file intdd6.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/intdd.F90 > ../obj/intdd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intdd.o ../obj/intdd.f ** intdd === End of Compilation 1 === 1501-510 Compilation successful for file intdd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/intdp.F90 > ../obj/intdp.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intdp.o ../obj/intdp.f ** intdp === End of Compilation 1 === 1501-510 Compilation successful for file intdp.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/intds.F90 > ../obj/intds.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intds.o ../obj/intds.f ** intds === End of Compilation 1 === 1501-510 Compilation successful for file intds.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/intpd.F90 > ../obj/intpd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intpd.o ../obj/intpd.f ** intpd === End of Compilation 1 === 1501-510 Compilation successful for file intpd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/intsd.F90 > ../obj/intsd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intsd.o ../obj/intsd.f ** intsd === End of Compilation 1 === 1501-510 Compilation successful for file intsd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/localdd.F90 > ../obj/localdd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/localdd.o ../obj/localdd.f ** localdd === End of Compilation 1 === "../obj/localdd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file localdd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/localdp.F90 > ../obj/localdp.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/localdp.o ../obj/localdp.f ** localdp === End of Compilation 1 === "../obj/localdp.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file localdp.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/localds.F90 > ../obj/localds.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/localds.o ../obj/localds.f ** localds === End of Compilation 1 === 1501-510 Compilation successful for file localds.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/localpd.F90 > ../obj/localpd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/localpd.o ../obj/localpd.f ** localpd === End of Compilation 1 === "../obj/localpd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file localpd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/localsd.F90 > ../obj/localsd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/localsd.o ../obj/localsd.f ** localsd === End of Compilation 1 === "../obj/localsd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file localsd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/overlap.F90 > ../obj/overlap.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/overlap.o ../obj/overlap.f ** overlap1 === End of Compilation 1 === ** ssoverlap === End of Compilation 2 === "../obj/overlap.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file overlap.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/overlp.F90 > ../obj/overlp.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/overlp.o ../obj/overlp.f ** overlp === End of Compilation 1 === ** sab === End of Compilation 2 === ** abintg === End of Compilation 3 === ** slimit === End of Compilation 4 === ** rtrans === End of Compilation 5 === ** rmatrx === End of Compilation 6 === "../obj/overlp.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/overlp.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/overlp.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/overlp.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file overlp.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/repuld.F90 > ../obj/repuld.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/repuld.o ../obj/repuld.f ** repuld === End of Compilation 1 === 1501-510 Compilation successful for file repuld.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/repul.F90 > ../obj/repul.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/repul.o ../obj/repul.f ** repul === End of Compilation 1 === ** rrep === End of Compilation 2 === "../obj/repul.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file repul.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/sabt.F90 > ../obj/sabt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/sabt.o ../obj/sabt.f ** sabt === End of Compilation 1 === ** calca === End of Compilation 2 === ** calcb === End of Compilation 3 === ** calcf === End of Compilation 4 === ** calcg === End of Compilation 5 === "../obj/sabt.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/sabt.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file sabt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/setdorb.F90 > ../obj/setdorb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/setdorb.o ../obj/setdorb.f ** setdorb === End of Compilation 1 === "../obj/setdorb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file setdorb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/slow.F90 > ../obj/slow.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/slow.o ../obj/slow.f ** slow === End of Compilation 1 === ** setint === End of Compilation 2 === ** dfunc === End of Compilation 3 === ** slowint === End of Compilation 4 === ** det3 === End of Compilation 5 === ** det5 === End of Compilation 6 === 1501-510 Compilation successful for file slow.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/slowi.F90 > ../obj/slowi.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/slowi.o ../obj/slowi.f ** slowinit === End of Compilation 1 === 1501-510 Compilation successful for file slowi.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/intRdKeys.F90 > ../obj/intRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intRdKeys.o ../obj/intRdKeys.f ** intrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file intRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/getversion.F90 > ../obj/getversion.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/getversion.o ../obj/getversion.f ** getversion === End of Compilation 1 === 1501-510 Compilation successful for file getversion.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/header.F90 > ../obj/header.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/header.o ../obj/header.f ** header === End of Compilation 1 === 1501-510 Compilation successful for file header.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/printen.F90 > ../obj/printen.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/printen.o ../obj/printen.f ** printen === End of Compilation 1 === 1501-510 Compilation successful for file printen.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/printpar.F90 > ../obj/printpar.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/printpar.o ../obj/printpar.f ** printpar === End of Compilation 1 === 1501-510 Compilation successful for file printpar.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/printsub.F90 > ../obj/printsub.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/printsub.o ../obj/printsub.f ** printsub === End of Compilation 1 === 1501-510 Compilation successful for file printsub.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdcoord.F90 > ../obj/rdcoord.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdcoord.o ../obj/rdcoord.f ** rdcoord === End of Compilation 1 === 1501-510 Compilation successful for file rdcoord.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdbelly.F90 > ../obj/rdbelly.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdbelly.o ../obj/rdbelly.f ** rdbelly === End of Compilation 1 === 1501-510 Compilation successful for file rdbelly.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdbox.F90 > ../obj/rdbox.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdbox.o ../obj/rdbox.f ** rdbox === End of Compilation 1 === "../obj/rdbox.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file rdbox.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdchemix.F90 > ../obj/rdchemix.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdchemix.o ../obj/rdchemix.f ** rdchemix === End of Compilation 1 === 1501-510 Compilation successful for file rdchemix.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdcluster.F90 > ../obj/rdcluster.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdcluster.o ../obj/rdcluster.f ** rdcluster === End of Compilation 1 === ** determinemaxsub === End of Compilation 2 === "../obj/rdcluster.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file rdcluster.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdcomb.F90 > ../obj/rdcomb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdcomb.o ../obj/rdcomb.f ** rdcomb === End of Compilation 1 === 1501-510 Compilation successful for file rdcomb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rddmx.F90 > ../obj/rddmx.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rddmx.o ../obj/rddmx.f ** rddmx === End of Compilation 1 === 1501-510 Compilation successful for file rddmx.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rddos.F90 > ../obj/rddos.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rddos.o ../obj/rddos.f ** rddos === End of Compilation 1 === 1501-510 Compilation successful for file rddos.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdgrid.F90 > ../obj/rdgrid.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdgrid.o ../obj/rdgrid.f ** rdgrid === End of Compilation 1 === "../obj/rdgrid.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file rdgrid.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdgroup.F90 > ../obj/rdgroup.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdgroup.o ../obj/rdgroup.f ** rdgroup === End of Compilation 1 === 1501-510 Compilation successful for file rdgroup.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdguess.F90 > ../obj/rdguess.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdguess.o ../obj/rdguess.f ** rdguess === End of Compilation 1 === 1501-510 Compilation successful for file rdguess.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdhess.F90 > ../obj/rdhess.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdhess.o ../obj/rdhess.f ** rdhess === End of Compilation 1 === 1501-510 Compilation successful for file rdhess.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdint.F90 > ../obj/rdint.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdint.o ../obj/rdint.f ** rdint === End of Compilation 1 === "../obj/rdint.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file rdint.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdkeys.F90 > ../obj/rdkeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdkeys.o ../obj/rdkeys.f ** rdkeys === End of Compilation 1 === "../obj/rdkeys.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file rdkeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdlist.F90 > ../obj/rdlist.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdlist.o ../obj/rdlist.f ** rdlist === End of Compilation 1 === 1501-510 Compilation successful for file rdlist.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdneighb.F90 > ../obj/rdneighb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdneighb.o ../obj/rdneighb.f ** rdneighb === End of Compilation 1 === 1501-510 Compilation successful for file rdneighb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdnext.F90 > ../obj/rdnext.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdnext.o ../obj/rdnext.f ** rdnext === End of Compilation 1 === 1501-510 Compilation successful for file rdnext.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdnmr.F90 > ../obj/rdnmr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdnmr.o ../obj/rdnmr.f ** rdnmr === End of Compilation 1 === 1501-510 Compilation successful for file rdnmr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdnum.F90 > ../obj/rdnum.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdnum.o ../obj/rdnum.f ** rdnum === End of Compilation 1 === ** getnum === End of Compilation 2 === ** whole === End of Compilation 3 === ** rdinum === End of Compilation 4 === ** getinum === End of Compilation 5 === ** iwhole === End of Compilation 6 === ** iatoi === End of Compilation 7 === ** iatoimp === End of Compilation 8 === "../obj/rdnum.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/rdnum.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file rdnum.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdpdb.F90 > ../obj/rdpdb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdpdb.o ../obj/rdpdb.f ** rdpdb === End of Compilation 1 === 1501-510 Compilation successful for file rdpdb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdprtvec.F90 > ../obj/rdprtvec.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdprtvec.o ../obj/rdprtvec.f ** rdprtvec === End of Compilation 1 === 1501-510 Compilation successful for file rdprtvec.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdrestraints.F90 > ../obj/rdrestraints.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdrestraints.o ../obj/rdrestraints.f ** rdrestraints === End of Compilation 1 === 1501-510 Compilation successful for file rdrestraints.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdrst.F90 > ../obj/rdrst.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdrst.o ../obj/rdrst.f ** rdrst === End of Compilation 1 === 1501-510 Compilation successful for file rdrst.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdsub.F90 > ../obj/rdsub.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdsub.o ../obj/rdsub.f ** rdsub === End of Compilation 1 === 1501-510 Compilation successful for file rdsub.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdtail.F90 > ../obj/rdtail.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdtail.o ../obj/rdtail.f ** rdtail === End of Compilation 1 === 1501-510 Compilation successful for file rdtail.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mm/ljglobals.F90 > ../obj/ljglobals.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/ljglobals.o ../obj/ljglobals.f ** ljglobals === End of Compilation 1 === 1501-510 Compilation successful for file ljglobals.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdvdw.F90 > ../obj/rdvdw.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdvdw.o ../obj/rdvdw.f ** rdvdw === End of Compilation 1 === 1501-510 Compilation successful for file rdvdw.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdword.F90 > ../obj/rdword.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdword.o ../obj/rdword.f ** rdword === End of Compilation 1 === 1501-510 Compilation successful for file rdword.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/rdxyz.F90 > ../obj/rdxyz.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rdxyz.o ../obj/rdxyz.f ** rdxyz === End of Compilation 1 === 1501-510 Compilation successful for file rdxyz.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtchg.F90 > ../obj/wrtchg.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtchg.o ../obj/wrtchg.f ** wrtchg === End of Compilation 1 === ** wrtch === End of Compilation 2 === "../obj/wrtchg.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file wrtchg.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtcoor.F90 > ../obj/wrtcoor.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtcoor.o ../obj/wrtcoor.f ** wrtcoor === End of Compilation 1 === 1501-510 Compilation successful for file wrtcoor.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtdefaultkeys.F90 > ../obj/wrtdefaultkeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtdefaultkeys.o ../obj/wrtdefaultkeys.f ** wrtdefaultkeys === End of Compilation 1 === ** describedefaultkeys === End of Compilation 2 === 1501-510 Compilation successful for file wrtdefaultkeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtdiv.F90 > ../obj/wrtdiv.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtdiv.o ../obj/wrtdiv.f ** wrtdiv === End of Compilation 1 === 1501-510 Compilation successful for file wrtdiv.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtdmx.F90 > ../obj/wrtdmx.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtdmx.o ../obj/wrtdmx.f ** wrtdmx === End of Compilation 1 === 1501-510 Compilation successful for file wrtdmx.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtgrd.F90 > ../obj/wrtgrd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtgrd.o ../obj/wrtgrd.f ** wrtgrd === End of Compilation 1 === ** wrtgrad === End of Compilation 2 === 1501-510 Compilation successful for file wrtgrd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrthss.F90 > ../obj/wrthss.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrthss.o ../obj/wrthss.f ** wrthss === End of Compilation 1 === 1501-510 Compilation successful for file wrthss.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtint.F90 > ../obj/wrtint.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtint.o ../obj/wrtint.f ** wrtint === End of Compilation 1 === 1501-510 Compilation successful for file wrtint.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtpdb.F90 > ../obj/wrtpdb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtpdb.o ../obj/wrtpdb.f ** wrtpdb === End of Compilation 1 === 1501-510 Compilation successful for file wrtpdb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtqma.F90 > ../obj/wrtqma.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtqma.o ../obj/wrtqma.f ** wrtqma === End of Compilation 1 === 1501-510 Compilation successful for file wrtqma.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtrep.F90 > ../obj/wrtrep.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtrep.o ../obj/wrtrep.f ** wrtrep === End of Compilation 1 === 1501-510 Compilation successful for file wrtrep.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtrst.F90 > ../obj/wrtrst.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtrst.o ../obj/wrtrst.f ** wrtrst === End of Compilation 1 === 1501-510 Compilation successful for file wrtrst.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrttim.F90 > ../obj/wrttim.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrttim.o ../obj/wrttim.f ** wrttims === End of Compilation 1 === ** wrttimmc === End of Compilation 2 === 1501-510 Compilation successful for file wrttim.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtvec.F90 > ../obj/wrtvec.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtvec.o ../obj/wrtvec.f ** wrtvec === End of Compilation 1 === "../obj/wrtvec.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file wrtvec.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtvecsub.F90 > ../obj/wrtvecsub.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtvecsub.o ../obj/wrtvecsub.f ** wrtvecsubf === End of Compilation 1 === ** wrtvecsub === End of Compilation 2 === "../obj/wrtvecsub.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/wrtvecsub.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file wrtvecsub.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/io/wrtxyz.F90 > ../obj/wrtxyz.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wrtxyz.o ../obj/wrtxyz.f ** wrtxyz === End of Compilation 1 === 1501-510 Compilation successful for file wrtxyz.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/block.F90 > ../obj/block.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/block.o ../obj/block.f ** initializedata === End of Compilation 1 === 1501-510 Compilation successful for file block.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/denful.F90 > ../obj/denful.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/denful.o ../obj/denful.f ** denful === End of Compilation 1 === 1501-510 Compilation successful for file denful.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/densub.F90 > ../obj/densub.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/densub.o ../obj/densub.f ** densub === End of Compilation 1 === "../obj/densub.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file densub.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/densubfdm.F90 > ../obj/densubfdm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/densubfdm.o ../obj/densubfdm.f ** densubfdm === End of Compilation 1 === "../obj/densubfdm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file densubfdm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/divcon.F90 > ../obj/divcon.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/divcon.o ../obj/divcon.f ** divcon === End of Compilation 1 === 1501-510 Compilation successful for file divcon.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/min/geoopt_module.F90 > ../obj/geoopt_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/geoopt_module.o ../obj/geoopt_module.f ** geoopt_module === End of Compilation 1 === 1501-510 Compilation successful for file geoopt_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/edriver.F90 > ../obj/edriver.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/edriver.o ../obj/edriver.f ** edriver === End of Compilation 1 === 1501-510 Compilation successful for file edriver.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/mosub.F90 > ../obj/mosub.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mosub.o ../obj/mosub.f ** mosub === End of Compilation 1 === 1501-510 Compilation successful for file mosub.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/mosubfdm.F90 > ../obj/mosubfdm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mosubfdm.o ../obj/mosubfdm.f ** mosubfdm === End of Compilation 1 === 1501-510 Compilation successful for file mosubfdm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/mosubfdmx.F90 > ../obj/mosubfdmx.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mosubfdmx.o ../obj/mosubfdmx.f ** mosubfdmx === End of Compilation 1 === 1501-510 Compilation successful for file mosubfdmx.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/mainRdKeys.F90 > ../obj/mainRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mainRdKeys.o ../obj/mainRdKeys.f ** mainrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file mainRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/math/diag.F90 > ../obj/diag.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/diag.o ../obj/diag.f ** diag === End of Compilation 1 === ** tridi === End of Compilation 2 === ** eigval === End of Compilation 3 === ** degen === End of Compilation 4 === ** eigvec === End of Compilation 5 === ** orthog === End of Compilation 6 === ** yrandom === End of Compilation 7 === "../obj/diag.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/diag.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/diag.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/diag.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/diag.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file diag.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/math/diagp.F90 > ../obj/diagp.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/diagp.o ../obj/diagp.f ** diagp === End of Compilation 1 === "../obj/diagp.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file diagp.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/math/fourier.F90 > ../obj/fourier.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/fourier.o ../obj/fourier.f ** rlft3 === End of Compilation 1 === ** fourn === End of Compilation 2 === "../obj/fourier.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file fourier.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/math/lsolve.F90 > ../obj/lsolve.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/lsolve.o ../obj/lsolve.f ** lsolve === End of Compilation 1 === "../obj/lsolve.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file lsolve.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/math/math.F90 > ../obj/math.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/math.o ../obj/math.f ** dgedi === End of Compilation 1 === ** dgefa === End of Compilation 2 === "../obj/math.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file math.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/math/normalization.F90 > ../obj/normalization.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/normalization.o ../obj/normalization.f ** xnorm === End of Compilation 1 === 1501-510 Compilation successful for file normalization.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/math/pdsyevd_driver.F90 > ../obj/pdsyevd_driver.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pdsyevd_driver.o ../obj/pdsyevd_driver.f ** pdsyevd_driver === End of Compilation 1 === 1501-510 Compilation successful for file pdsyevd_driver.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/math/pdsyevx_driver.F90 > ../obj/pdsyevx_driver.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pdsyevx_driver.o ../obj/pdsyevx_driver.f ** pdsyevx_driver === End of Compilation 1 === 1501-510 Compilation successful for file pdsyevx_driver.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/math/zheev.F90 > ../obj/zheev.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/zheev.o ../obj/zheev.f ** zheev_dummy === End of Compilation 1 === 1501-510 Compilation successful for file zheev.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/boxmove.F90 > ../obj/boxmove.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/boxmove.o ../obj/boxmove.f ** boxmove === End of Compilation 1 === "../obj/boxmove.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file boxmove.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/boxstep.F90 > ../obj/boxstep.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/boxstep.o ../obj/boxstep.f ** boxstep === End of Compilation 1 === "../obj/boxstep.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file boxstep.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/dovir.F90 > ../obj/dovir.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dovir.o ../obj/dovir.f ** dovir === End of Compilation 1 === 1501-510 Compilation successful for file dovir.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/gcartmc.F90 > ../obj/gcartmc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/gcartmc.o ../obj/gcartmc.f ** gcartmc === End of Compilation 1 === "../obj/gcartmc.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file gcartmc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/getrforc.F90 > ../obj/getrforc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/getrforc.o ../obj/getrforc.f ** getrforc === End of Compilation 1 === 1501-510 Compilation successful for file getrforc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/mccopy.F90 > ../obj/mccopy.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mccopy.o ../obj/mccopy.f ** mccopynew === End of Compilation 1 === ** mccopyold === End of Compilation 2 === 1501-510 Compilation successful for file mccopy.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/mcsetup.F90 > ../obj/mcsetup.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mcsetup.o ../obj/mcsetup.f ** mcsetup === End of Compilation 1 === ** mcupdate === End of Compilation 2 === ** mcclose === End of Compilation 3 === 1501-510 Compilation successful for file mcsetup.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/nptdriver.F90 > ../obj/nptdriver.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/nptdriver.o ../obj/nptdriver.f ** nptdriver === End of Compilation 1 === 1501-510 Compilation successful for file nptdriver.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/nvtdriver.F90 > ../obj/nvtdriver.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/nvtdriver.o ../obj/nvtdriver.f ** nvtdriver === End of Compilation 1 === 1501-510 Compilation successful for file nvtdriver.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/resmove.F90 > ../obj/resmove.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/resmove.o ../obj/resmove.f ** resmove === End of Compilation 1 === "../obj/resmove.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file resmove.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/resstep.F90 > ../obj/resstep.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/resstep.o ../obj/resstep.f ** resstep === End of Compilation 1 === "../obj/resstep.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file resstep.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/rottr.F90 > ../obj/rottr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rottr.o ../obj/rottr.f ** rottr === End of Compilation 1 === "../obj/rottr.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file rottr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/setbox.F90 > ../obj/setbox.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/setbox.o ../obj/setbox.f ** setbox === End of Compilation 1 === "../obj/setbox.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file setbox.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mc/submove.F90 > ../obj/submove.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/submove.o ../obj/submove.f ** submove === End of Compilation 1 === "../obj/submove.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file submove.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocatevars.F90 > ../obj/allocatevars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocatevars.o ../obj/allocatevars.f ** allocatevars === End of Compilation 1 === ** allocatemslistvars === End of Compilation 2 === ** allocatemsorbvars === End of Compilation 3 === ** allocatemsvalvars === End of Compilation 4 === ** allocatembpairvars === End of Compilation 5 === ** allocatemxdiatvars === End of Compilation 6 === ** allocatemxdiagvars === End of Compilation 7 === ** allocatemaxrepvars === End of Compilation 8 === ** allocatemxfdiavars === End of Compilation 9 === 1501-510 Compilation successful for file allocatevars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/deallocatevars.F90 > ../obj/deallocatevars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/deallocatevars.o ../obj/deallocatevars.f ** deallocatevars === End of Compilation 1 === ** deallocatenmrvars === End of Compilation 2 === 1501-510 Compilation successful for file deallocatevars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocateDcVars.F90 > ../obj/allocateDcVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocateDcVars.o ../obj/allocateDcVars.f ** allocatedcvars === End of Compilation 1 === 1501-510 Compilation successful for file allocateDcVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocateIntVars.F90 > ../obj/allocateIntVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocateIntVars.o ../obj/allocateIntVars.f ** allocateintvars === End of Compilation 1 === 1501-510 Compilation successful for file allocateIntVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocateMmVars.F90 > ../obj/allocateMmVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocateMmVars.o ../obj/allocateMmVars.f ** allocatemmvars === End of Compilation 1 === 1501-510 Compilation successful for file allocateMmVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocateFreqVars.F90 > ../obj/allocateFreqVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocateFreqVars.o ../obj/allocateFreqVars.f ** allocatefreqvars === End of Compilation 1 === 1501-510 Compilation successful for file allocateFreqVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocateGuessVars.F90 > ../obj/allocateGuessVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocateGuessVars.o ../obj/allocateGuessVars.f ** allocateguessvars === End of Compilation 1 === 1501-510 Compilation successful for file allocateGuessVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocateMcVars.F90 > ../obj/allocateMcVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocateMcVars.o ../obj/allocateMcVars.f ** allocatemcvars === End of Compilation 1 === 1501-510 Compilation successful for file allocateMcVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocateMinVars.F90 > ../obj/allocateMinVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocateMinVars.o ../obj/allocateMinVars.f ** allocateminvars === End of Compilation 1 === ** allocatebellyvars === End of Compilation 2 === 1501-510 Compilation successful for file allocateMinVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocateNmrVars.F90 > ../obj/allocateNmrVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocateNmrVars.o ../obj/allocateNmrVars.f ** allocatenmrvars1 === End of Compilation 1 === ** allocatenmrvars2 === End of Compilation 2 === 1501-510 Compilation successful for file allocateNmrVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocateParamVars.F90 > ../obj/allocateParamVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocateParamVars.o ../obj/allocateParamVars.f ** allocateparamvars === End of Compilation 1 === 1501-510 Compilation successful for file allocateParamVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocatePmeVars.F90 > ../obj/allocatePmeVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocatePmeVars.o ../obj/allocatePmeVars.f ** allocatepmevars === End of Compilation 1 === 1501-510 Compilation successful for file allocatePmeVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocateScrfVars.F90 > ../obj/allocateScrfVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocateScrfVars.o ../obj/allocateScrfVars.f ** allocatescrfvars === End of Compilation 1 === 1501-510 Compilation successful for file allocateScrfVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocateToolsVars.F90 > ../obj/allocateToolsVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocateToolsVars.o ../obj/allocateToolsVars.f ** allocatetoolsvars === End of Compilation 1 === 1501-510 Compilation successful for file allocateToolsVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/min/bsrch.F90 > ../obj/bsrch.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/bsrch.o ../obj/bsrch.f ** bsrch === End of Compilation 1 === "../obj/bsrch.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file bsrch.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/min/diislb.F90 > ../obj/diislb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/diislb.o ../obj/diislb.f ** diislb === End of Compilation 1 === ** lsolve2 === End of Compilation 2 === "../obj/diislb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/diislb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file diislb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/min/diisub.F90 > ../obj/diisub.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/diisub.o ../obj/diisub.f ** diisub === End of Compilation 1 === ** savset === End of Compilation 2 === "../obj/diisub.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file diisub.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/min/geoopt.F90 > ../obj/geoopt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/geoopt.o ../obj/geoopt.f ** geoopt === End of Compilation 1 === ** flabel === End of Compilation 2 === "../obj/geoopt.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file geoopt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/min/getdir.F90 > ../obj/getdir.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/getdir.o ../obj/getdir.f ** getdir === End of Compilation 1 === "../obj/getdir.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file getdir.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/min/lbfgs.F90 > ../obj/lbfgs.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/lbfgs.o ../obj/lbfgs.f ** lb2 === End of Compilation 1 === ** lbfgs === End of Compilation 2 === ** lb1 === End of Compilation 3 === ** mcsrch === End of Compilation 4 === ** mcstep === End of Compilation 5 === "../obj/lbfgs.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/lbfgs.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/lbfgs.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file lbfgs.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/min/linmin.F90 > ../obj/linmin.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/linmin.o ../obj/linmin.f ** linmin === End of Compilation 1 === "../obj/linmin.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file linmin.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mm/getmm.F90 > ../obj/getmm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/getmm.o ../obj/getmm.f ** getmm === End of Compilation 1 === 1501-510 Compilation successful for file getmm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mm/getpep.F90 > ../obj/getpep.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/getpep.o ../obj/getpep.f ** getpep === End of Compilation 1 === 1501-510 Compilation successful for file getpep.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mm/ljint.F90 > ../obj/ljint.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/ljint.o ../obj/ljint.f ** ljint === End of Compilation 1 === ** psm === End of Compilation 2 === ** angle === End of Compilation 3 === ** dihedral === End of Compilation 4 === ** veccross === End of Compilation 5 === ** vecdiff === End of Compilation 6 === "../obj/ljint.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/ljint.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/ljint.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/ljint.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/ljint.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/ljint.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file ljint.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mm/mmroutines.F90 > ../obj/mmroutines.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mmroutines.o ../obj/mmroutines.f ** bond_e === End of Compilation 1 === ** angle_e === End of Compilation 2 === ** tor_e === End of Compilation 3 === 1501-510 Compilation successful for file mmroutines.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mm/restraint.F90 > ../obj/restraint.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/restraint.o ../obj/restraint.f ** set_restraints === End of Compilation 1 === ** energy_restraints === End of Compilation 2 === ** grad_restraints === End of Compilation 3 === 1501-510 Compilation successful for file restraint.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mm/mmDriver.F90 > ../obj/mmDriver.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mmDriver.o ../obj/mmDriver.f ** mmdriver === End of Compilation 1 === 1501-510 Compilation successful for file mmDriver.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mpi/balance.F90 > ../obj/balance.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/balance.o ../obj/balance.f ** balance_bynorbs === End of Compilation 1 === ** balance_bytime === End of Compilation 2 === ** mpi_error_check === End of Compilation 3 === 1501-510 Compilation successful for file balance.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mpi/set_mpi_init.F90 > ../obj/set_mpi_init.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/set_mpi_init.o ../obj/set_mpi_init.f ** set_mpi_init === End of Compilation 1 === 1501-510 Compilation successful for file set_mpi_init.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/nmr/assignbasis.F90 > ../obj/assignbasis.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/assignbasis.o ../obj/assignbasis.f ** assignbasis === End of Compilation 1 === 1501-510 Compilation successful for file assignbasis.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/nmr/chshift.F90 > ../obj/chshift.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/chshift.o ../obj/chshift.f ** chshift === End of Compilation 1 === ** diam === End of Compilation 2 === ** paramg === End of Compilation 3 === ** diam1 === End of Compilation 4 === ** diam2 === End of Compilation 5 === ** apscreen === End of Compilation 6 === "../obj/chshift.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/chshift.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file chshift.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/nmr/nmrdenful.F90 > ../obj/nmrdenful.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/nmrdenful.o ../obj/nmrdenful.f ** nmrdenful === End of Compilation 1 === "../obj/nmrdenful.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file nmrdenful.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/nmr/nmrdensub.F90 > ../obj/nmrdensub.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/nmrdensub.o ../obj/nmrdensub.f ** nmrdensub === End of Compilation 1 === "../obj/nmrdensub.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file nmrdensub.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/nmr/nmrdmx.F90 > ../obj/nmrdmx.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/nmrdmx.o ../obj/nmrdmx.f ** nmrdmx === End of Compilation 1 === 1501-510 Compilation successful for file nmrdmx.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/nmr/nmresqr.F90 > ../obj/nmresqr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/nmresqr.o ../obj/nmresqr.f ** nmresqr === End of Compilation 1 === 1501-510 Compilation successful for file nmresqr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/nmr/oethccs.F90 > ../obj/oethccs.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/oethccs.o ../obj/oethccs.f ** oethccs1 === End of Compilation 1 === ** oethccs2 === End of Compilation 2 === ** oethccs3 === End of Compilation 3 === ** oethccs4 === End of Compilation 4 === ** oethccs5 === End of Compilation 5 === ** oethccs6 === End of Compilation 6 === "../obj/oethccs.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file oethccs.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/param/coppnt.F90 > ../obj/coppnt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/coppnt.o ../obj/coppnt.f ** coppnt === End of Compilation 1 === "../obj/coppnt.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file coppnt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/param/error.F90 > ../obj/error.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/error.o ../obj/error.f ** error === End of Compilation 1 === 1501-510 Compilation successful for file error.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/param/loop.F90 > ../obj/loop.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/loop.o ../obj/loop.f ** loop === End of Compilation 1 === 1501-510 Compilation successful for file loop.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/param/parop2.F90 > ../obj/parop2.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/parop2.o ../obj/parop2.f ** parop2 === End of Compilation 1 === "../obj/parop2.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file parop2.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/param/parop.F90 > ../obj/parop.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/parop.o ../obj/parop.f ** parop === End of Compilation 1 === "../obj/parop.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file parop.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/param/recalc.F90 > ../obj/recalc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/recalc.o ../obj/recalc.f ** recalc === End of Compilation 1 === 1501-510 Compilation successful for file recalc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/param/tstpnt.F90 > ../obj/tstpnt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/tstpnt.o ../obj/tstpnt.f ** tstpnt === End of Compilation 1 === 1501-510 Compilation successful for file tstpnt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/chk_run_delphi.F90 > ../obj/chk_run_delphi.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/chk_run_delphi.o ../obj/chk_run_delphi.f ** chk_run_delphi === End of Compilation 1 === 1501-510 Compilation successful for file chk_run_delphi.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/divpb.F90 > ../obj/divpb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/divpb.o ../obj/divpb.f ** divpb === End of Compilation 1 === 1501-510 Compilation successful for file divpb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpaccelerate.F90 > ../obj/dpaccelerate.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpaccelerate.o ../obj/dpaccelerate.f ** dpaccelerate === End of Compilation 1 === 1501-510 Compilation successful for file dpaccelerate.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpchargegrid.F90 > ../obj/dpchargegrid.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpchargegrid.o ../obj/dpchargegrid.f ** dpchargegrid === End of Compilation 1 === 1501-510 Compilation successful for file dpchargegrid.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpcollectsurfcharge.F90 > ../obj/dpcollectsurfcharge.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpcollectsurfcharge.o ../obj/dpcollectsurfcharge.f ** dpcollectsurfcharge === End of Compilation 1 === "../obj/dpcollectsurfcharge.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file dpcollectsurfcharge.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpfinesurfprep.F90 > ../obj/dpfinesurfprep.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpfinesurfprep.o ../obj/dpfinesurfprep.f ** dpfinesurfprep === End of Compilation 1 === 1501-510 Compilation successful for file dpfinesurfprep.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpfinesurfacc.F90 > ../obj/dpfinesurfacc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpfinesurfacc.o ../obj/dpfinesurfacc.f ** dpfinesurfacc === End of Compilation 1 === 1501-510 Compilation successful for file dpfinesurfacc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpfinesurfrelax.F90 > ../obj/dpfinesurfrelax.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpfinesurfrelax.o ../obj/dpfinesurfrelax.f ** dpfinesurfrelax === End of Compilation 1 === "../obj/dpfinesurfrelax.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file dpfinesurfrelax.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpgetmol.F90 > ../obj/dpgetmol.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpgetmol.o ../obj/dpgetmol.f ** dpgetmol === End of Compilation 1 === "../obj/dpgetmol.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file dpgetmol.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpinit.F90 > ../obj/dpinit.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpinit.o ../obj/dpinit.f ** dpinit === End of Compilation 1 === ** dpreadparam === End of Compilation 2 === ** dpreadradii === End of Compilation 3 === 1501-510 Compilation successful for file dpinit.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dploop.F90 > ../obj/dploop.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dploop.o ../obj/dploop.f ** dploop === End of Compilation 1 === "../obj/dploop.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file dploop.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpmakegrid.F90 > ../obj/dpmakegrid.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpmakegrid.o ../obj/dpmakegrid.f ** dpmakegrid === End of Compilation 1 === "../obj/dpmakegrid.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file dpmakegrid.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpmakesurface.F90 > ../obj/dpmakesurface.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpmakesurface.o ../obj/dpmakesurface.f ** dpmakesurface === End of Compilation 1 === 1501-510 Compilation successful for file dpmakesurface.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpsetepsilon.F90 > ../obj/dpsetepsilon.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpsetepsilon.o ../obj/dpsetepsilon.f ** dpsetepsilon === End of Compilation 1 === "../obj/dpsetepsilon.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file dpsetepsilon.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/dpsetphi.F90 > ../obj/dpsetphi.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dpsetphi.o ../obj/dpsetphi.f ** dpsetphi === End of Compilation 1 === 1501-510 Compilation successful for file dpsetphi.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/nonpolar2.F90 > ../obj/nonpolar2.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/nonpolar2.o ../obj/nonpolar2.f ** nonpolar2 === End of Compilation 1 === 1501-510 Compilation successful for file nonpolar2.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/pbfock.F90 > ../obj/pbfock.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pbfock.o ../obj/pbfock.f ** pbfock === End of Compilation 1 === 1501-510 Compilation successful for file pbfock.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/pb_mds.F90 > ../obj/pb_mds.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pb_mds.o ../obj/pb_mds.f ** pb_mds === End of Compilation 1 === "../obj/pb_mds.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pb_mds.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/pb_putpnt.F90 > ../obj/pb_putpnt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pb_putpnt.o ../obj/pb_putpnt.f ** pb_putpnt === End of Compilation 1 === "../obj/pb_putpnt.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pb_putpnt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/pbsolver.F90 > ../obj/pbsolver.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pbsolver.o ../obj/pbsolver.f ** pbsolver === End of Compilation 1 === "../obj/pbsolver.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pbsolver.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/pb_spt.F90 > ../obj/pb_spt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pb_spt.o ../obj/pb_spt.f ** pb_spt === End of Compilation 1 === 1501-510 Compilation successful for file pb_spt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/pb_subdiv.F90 > ../obj/pb_subdiv.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pb_subdiv.o ../obj/pb_subdiv.f ** pb_subdiv === End of Compilation 1 === ** pb_subcir === End of Compilation 2 === ** pb_subarc === End of Compilation 3 === "../obj/pb_subdiv.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pb_subdiv.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/pb_vector.F90 > ../obj/pb_vector.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pb_vector.o ../obj/pb_vector.f ** pb_dis === End of Compilation 1 === ** pb_dis2 === End of Compilation 2 === ** pb_disptl === End of Compilation 3 === ** pb_dot === End of Compilation 4 === ** pb_cross === End of Compilation 5 === ** pb_triple === End of Compilation 6 === ** pb_normal === End of Compilation 7 === "../obj/pb_vector.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/pb_vector.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/pb_vector.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/pb_vector.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pb_vector.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pb/pbDriver.F90 > ../obj/pbDriver.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pbDriver.o ../obj/pbDriver.f ** pbdriver === End of Compilation 1 === 1501-510 Compilation successful for file pbDriver.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_calcb.F90 > ../obj/pme_calcb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_calcb.o ../obj/pme_calcb.f ** pme_calcb === End of Compilation 1 === "../obj/pme_calcb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pme_calcb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_calcq.F90 > ../obj/pme_calcq.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_calcq.o ../obj/pme_calcq.f ** pme_calcq === End of Compilation 1 === "../obj/pme_calcq.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pme_calcq.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_calcqmc.F90 > ../obj/pme_calcqmc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_calcqmc.o ../obj/pme_calcqmc.f ** pme_calcqmc === End of Compilation 1 === "../obj/pme_calcqmc.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pme_calcqmc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_calctheta.F90 > ../obj/pme_calctheta.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_calctheta.o ../obj/pme_calctheta.f ** pme_calctheta === End of Compilation 1 === "../obj/pme_calctheta.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pme_calctheta.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_derec.F90 > ../obj/pme_derec.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_derec.o ../obj/pme_derec.f ** pme_derec === End of Compilation 1 === "../obj/pme_derec.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pme_derec.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_derecmc.F90 > ../obj/pme_derecmc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_derecmc.o ../obj/pme_derecmc.f ** pme_derecmc === End of Compilation 1 === "../obj/pme_derecmc.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pme_derecmc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_direct.F90 > ../obj/pme_direct.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_direct.o ../obj/pme_direct.f ** pme_direct === End of Compilation 1 === "../obj/pme_direct.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pme_direct.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_directmc.F90 > ../obj/pme_directmc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_directmc.o ../obj/pme_directmc.f ** pme_directmc === End of Compilation 1 === "../obj/pme_directmc.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pme_directmc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_erec.F90 > ../obj/pme_erec.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_erec.o ../obj/pme_erec.f ** pme_erec === End of Compilation 1 === ** mbspline === End of Compilation 2 === "../obj/pme_erec.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/pme_erec.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pme_erec.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_erecmc.F90 > ../obj/pme_erecmc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_erecmc.o ../obj/pme_erecmc.f ** pme_erecmc === End of Compilation 1 === ** mbsplinemc === End of Compilation 2 === "../obj/pme_erecmc.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pme_erecmc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_recip.F90 > ../obj/pme_recip.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_recip.o ../obj/pme_recip.f ** pme_recip === End of Compilation 1 === 1501-510 Compilation successful for file pme_recip.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_recipmc.F90 > ../obj/pme_recipmc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_recipmc.o ../obj/pme_recipmc.f ** pme_recipmc === End of Compilation 1 === 1501-510 Compilation successful for file pme_recipmc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pme_setup.F90 > ../obj/pme_setup.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pme_setup.o ../obj/pme_setup.f ** pme_setup === End of Compilation 1 === "../obj/pme_setup.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pme_setup.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/pme/pmeDriver.F90 > ../obj/pmeDriver.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pmeDriver.o ../obj/pmeDriver.f ** pmedriver === End of Compilation 1 === 1501-510 Compilation successful for file pmeDriver.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/scf/fmix.F90 > ../obj/fmix.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/fmix.o ../obj/fmix.f ** fmix === End of Compilation 1 === ** decalc === End of Compilation 2 === "../obj/fmix.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file fmix.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/scf/escf.F90 > ../obj/escf.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/escf.o ../obj/escf.f ** escf === End of Compilation 1 === 1501-510 Compilation successful for file escf.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/scf/initp.F90 > ../obj/initp.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/initp.o ../obj/initp.f ** initp === End of Compilation 1 === "../obj/initp.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file initp.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/scf/pmix.F90 > ../obj/pmix.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pmix.o ../obj/pmix.f ** pmix === End of Compilation 1 === "../obj/pmix.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pmix.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/setup/assign.F90 > ../obj/assign.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/assign.o ../obj/assign.f ** assign === End of Compilation 1 === 1501-510 Compilation successful for file assign.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/setup/atmlist.F90 > ../obj/atmlist.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/atmlist.o ../obj/atmlist.f ** atmlst === End of Compilation 1 === "../obj/atmlist.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file atmlist.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/setup/glbpnt.F90 > ../obj/glbpnt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/glbpnt.o ../obj/glbpnt.f ** glbpnt === End of Compilation 1 === 1501-510 Compilation successful for file glbpnt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/setup/initializeVars.F90 > ../obj/initializeVars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/initializeVars.o ../obj/initializeVars.f ** initializeglobalvariables === End of Compilation 1 === 1501-510 Compilation successful for file initializeVars.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/setup/intpr.F90 > ../obj/intpr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/intpr.o ../obj/intpr.f ** intpr === End of Compilation 1 === ** getvalue === End of Compilation 2 === 1501-510 Compilation successful for file intpr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/setup/setdef.F90 > ../obj/setdef.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/setdef.o ../obj/setdef.f ** setdef === End of Compilation 1 === "../obj/setdef.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file setdef.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/setup/setname2.F90 > ../obj/setname2.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/setname2.o ../obj/setname2.f ** setname === End of Compilation 1 === 1501-510 Compilation successful for file setname2.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/setup/setopt.F90 > ../obj/setopt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/setopt.o ../obj/setopt.f ** setopt === End of Compilation 1 === 1501-510 Compilation successful for file setopt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/setup/setup.F90 > ../obj/setup.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/setup.o ../obj/setup.f ** setup === End of Compilation 1 === 1501-510 Compilation successful for file setup.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/setup/stripkeywd.F90 > ../obj/stripkeywd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/stripkeywd.o ../obj/stripkeywd.f ** stripkeywd === End of Compilation 1 === ** stripkeymc === End of Compilation 2 === 1501-510 Compilation successful for file stripkeywd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/atmchg.F90 > ../obj/atmchg.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/atmchg.o ../obj/atmchg.f ** atmchg === End of Compilation 1 === ** getcm1a === End of Compilation 2 === ** calccm1a === End of Compilation 3 === ** getcm1p === End of Compilation 4 === ** calccm1p === End of Compilation 5 === ** getcm2a === End of Compilation 6 === ** getcm2p === End of Compilation 7 === "../obj/atmchg.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file atmchg.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/bcheck.F90 > ../obj/bcheck.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/bcheck.o ../obj/bcheck.f ** bcheck === End of Compilation 1 === 1501-510 Compilation successful for file bcheck.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/dipole.F90 > ../obj/dipole.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dipole.o ../obj/dipole.f "../obj/dipole.f", line 50.1: 1511-007 (W) An END DO should only be used to close one DO loop or one DO WHILE loop. "../obj/dipole.f", line 61.1: 1511-007 (W) An END DO should only be used to close one DO loop or one DO WHILE loop. "../obj/dipole.f", line 75.1: 1511-007 (W) An END DO should only be used to close one DO loop or one DO WHILE loop. ** dipole === End of Compilation 1 === "../obj/dipole.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file dipole.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/homolumo.F90 > ../obj/homolumo.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/homolumo.o ../obj/homolumo.f ** homolumo === End of Compilation 1 === "../obj/homolumo.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file homolumo.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/mkdos.F90 > ../obj/mkdos.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mkdos.o ../obj/mkdos.f ** mkdos === End of Compilation 1 === ** gendos === End of Compilation 2 === "../obj/mkdos.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/mkdos.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file mkdos.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/push.F90 > ../obj/push.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/push.o ../obj/push.f ** push === End of Compilation 1 === 1501-510 Compilation successful for file push.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/pwdecomp.F90 > ../obj/pwdecomp.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pwdecomp.o ../obj/pwdecomp.f ** pwdecomp === End of Compilation 1 === ** zerof === End of Compilation 2 === ** indw === End of Compilation 3 === "../obj/pwdecomp.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file pwdecomp.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/rotate.F90 > ../obj/rotate.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rotate.o ../obj/rotate.f ** rotate === End of Compilation 1 === "../obj/rotate.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file rotate.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/thermo.F90 > ../obj/thermo.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/thermo.o ../obj/thermo.f ** dothermo === End of Compilation 1 === "../obj/thermo.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file thermo.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/toolsRdKeys.F90 > ../obj/toolsRdKeys.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/toolsRdKeys.o ../obj/toolsRdKeys.f ** toolsrdkeys === End of Compilation 1 === 1501-510 Compilation successful for file toolsRdKeys.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/toolsRdTail.F90 > ../obj/toolsRdTail.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/toolsRdTail.o ../obj/toolsRdTail.f ** toolsrdtail === End of Compilation 1 === 1501-510 Compilation successful for file toolsRdTail.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/toolsDriver.F90 > ../obj/toolsDriver.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/toolsDriver.o ../obj/toolsDriver.f ** toolsdriver === End of Compilation 1 === 1501-510 Compilation successful for file toolsDriver.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/tools/rderror.F90 > ../obj/rderror.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rderror.o ../obj/rderror.f ** rderror === End of Compilation 1 === 1501-510 Compilation successful for file rderror.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ts/geots.F90 > ../obj/geots.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/geots.o ../obj/geots.f ** geots === End of Compilation 1 === "../obj/geots.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file geots.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ts/prjfc.F90 > ../obj/prjfc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/prjfc.o ../obj/prjfc.f ** prjfc === End of Compilation 1 === "../obj/prjfc.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file prjfc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ts/septs.F90 > ../obj/septs.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/septs.o ../obj/septs.f ** septs === End of Compilation 1 === 1501-510 Compilation successful for file septs.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ts/tsqna.F90 > ../obj/tsqna.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/tsqna.o ../obj/tsqna.f ** tsqna === End of Compilation 1 === ** vlambda === End of Compilation 2 === ** stepnr === End of Compilation 3 === ** rootv === End of Compilation 4 === "../obj/tsqna.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/tsqna.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/tsqna.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/tsqna.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file tsqna.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/ts/tsrfo.F90 > ../obj/tsrfo.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/tsrfo.o ../obj/tsrfo.f ** tsrfo === End of Compilation 1 === ** vmax === End of Compilation 2 === ** vrms === End of Compilation 3 === ** jacobi === End of Compilation 4 === ** sort2 === End of Compilation 5 === "../obj/tsrfo.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/tsrfo.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/tsrfo.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "../obj/tsrfo.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file tsrfo.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/av.F90 > ../obj/av.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/av.o ../obj/av.f ** av === End of Compilation 1 === 1501-510 Compilation successful for file av.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/binloc_index.F90 > ../obj/binloc_index.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/binloc_index.o ../obj/binloc_index.f ** binloc_index === End of Compilation 1 === 1501-510 Compilation successful for file binloc_index.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/bleng.F90 > ../obj/bleng.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/bleng.o ../obj/bleng.f ** bleng === End of Compilation 1 === 1501-510 Compilation successful for file bleng.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/bndang.F90 > ../obj/bndang.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/bndang.o ../obj/bndang.f ** bndang === End of Compilation 1 === 1501-510 Compilation successful for file bndang.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/bpair.F90 > ../obj/bpair.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/bpair.o ../obj/bpair.f ** bpair === End of Compilation 1 === 1501-510 Compilation successful for file bpair.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/bsort.F90 > ../obj/bsort.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/bsort.o ../obj/bsort.f ** bsort === End of Compilation 1 === ** bsort1 === End of Compilation 2 === ** busort === End of Compilation 3 === ** busort1 === End of Compilation 4 === ** bovsort1 === End of Compilation 5 === ** rsort === End of Compilation 6 === ** rsort2 === End of Compilation 7 === ** bsort2 === End of Compilation 8 === ** bsort3 === End of Compilation 9 === 1501-510 Compilation successful for file bsort.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/bspline.F90 > ../obj/bspline.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/bspline.o ../obj/bspline.f ** mbspline1 === End of Compilation 1 === ** mkbspline === End of Compilation 2 === 1501-510 Compilation successful for file bspline.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/calcgeo.F90 > ../obj/calcgeo.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/calcgeo.o ../obj/calcgeo.f ** calcgeo === End of Compilation 1 === "../obj/calcgeo.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file calcgeo.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/chkovlp.F90 > ../obj/chkovlp.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/chkovlp.o ../obj/chkovlp.f ** chkovlp === End of Compilation 1 === 1501-510 Compilation successful for file chkovlp.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/diffp_stat.F90 > ../obj/diffp_stat.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/diffp_stat.o ../obj/diffp_stat.f ** diffp_stat === End of Compilation 1 === ** diffp_prt_stat === End of Compilation 2 === ** diffp_prt_hist === End of Compilation 3 === "../obj/diffp_stat.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file diffp_stat.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/dihedr.F90 > ../obj/dihedr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dihedr.o ../obj/dihedr.f ** dihedr === End of Compilation 1 === "../obj/dihedr.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file dihedr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/dograd.F90 > ../obj/dograd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dograd.o ../obj/dograd.f ** dograd === End of Compilation 1 === 1501-510 Compilation successful for file dograd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/etimer.F90 > ../obj/etimer.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/etimer.o ../obj/etimer.f ** etimer === End of Compilation 1 === ** myclock === End of Compilation 2 === 1501-510 Compilation successful for file etimer.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/g2int.F90 > ../obj/g2int.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/g2int.o ../obj/g2int.f ** g2int === End of Compilation 1 === 1501-510 Compilation successful for file g2int.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/gcart.F90 > ../obj/gcart.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/gcart.o ../obj/gcart.f ** gcart === End of Compilation 1 === "../obj/gcart.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file gcart.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/getcrd.F90 > ../obj/getcrd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/getcrd.o ../obj/getcrd.f ** getcrd === End of Compilation 1 === 1501-510 Compilation successful for file getcrd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/getpar2.F90 > ../obj/getpar2.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/getpar2.o ../obj/getpar2.f ** getpar2 === End of Compilation 1 === 1501-510 Compilation successful for file getpar2.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/getpar.F90 > ../obj/getpar.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/getpar.o ../obj/getpar.f "../obj/getpar.f", line 107.1: 1511-007 (W) An END DO should only be used to close one DO loop or one DO WHILE loop. "../obj/getpar.f", line 111.1: 1511-007 (W) An END DO should only be used to close one DO loop or one DO WHILE loop. ** getpar === End of Compilation 1 === 1501-510 Compilation successful for file getpar.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/getxyz.F90 > ../obj/getxyz.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/getxyz.o ../obj/getxyz.f ** getxyz === End of Compilation 1 === "../obj/getxyz.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file getxyz.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/icoord.F90 > ../obj/icoord.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/icoord.o ../obj/icoord.f ** icoord === End of Compilation 1 === 1501-510 Compilation successful for file icoord.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/ijpair.F90 > ../obj/ijpair.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/ijpair.o ../obj/ijpair.f ** ijmake === End of Compilation 1 === ** ijfind === End of Compilation 2 === ** binloc === End of Compilation 3 === "../obj/ijpair.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file ijpair.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/mcweeny.F90 > ../obj/mcweeny.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mcweeny.o ../obj/mcweeny.f ** mcweeny === End of Compilation 1 === ** getrow === End of Compilation 2 === 1501-510 Compilation successful for file mcweeny.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/mvcrd.F90 > ../obj/mvcrd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/mvcrd.o ../obj/mvcrd.f ** mvcrd === End of Compilation 1 === 1501-510 Compilation successful for file mvcrd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/namemcf.F90 > ../obj/namemcf.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/namemcf.o ../obj/namemcf.f ** namemcf === End of Compilation 1 === 1501-510 Compilation successful for file namemcf.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/int/oned.F90 > ../obj/oned.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/oned.o ../obj/oned.f ** oned === End of Compilation 1 === "../obj/oned.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file oned.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/opnfil.F90 > ../obj/opnfil.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/opnfil.o ../obj/opnfil.f ** opnfil === End of Compilation 1 === ** opnpfil === End of Compilation 2 === ** opnpfil1 === End of Compilation 3 === 1501-510 Compilation successful for file opnfil.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/out2stream.F90 > ../obj/out2stream.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/out2stream.o ../obj/out2stream.f ** out2stream === End of Compilation 1 === ** openstream === End of Compilation 2 === ** iunit_inv === End of Compilation 3 === 1501-510 Compilation successful for file out2stream.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/out2xml.F90 > ../obj/out2xml.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/out2xml.o ../obj/out2xml.f ** out2xml === End of Compilation 1 === 1501-510 Compilation successful for file out2xml.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/pbcxyz.F90 > ../obj/pbcxyz.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/pbcxyz.o ../obj/pbcxyz.f ** pbcxyz === End of Compilation 1 === 1501-510 Compilation successful for file pbcxyz.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/random.F90 > ../obj/random.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/random.o ../obj/random.f "../obj/random.f", 1513-006 (E) FUNCTION or ENTRY result is not set in the program unit. ** xrandom === End of Compilation 1 === "../obj/random.f", 1513-006 (E) FUNCTION or ENTRY result is not set in the program unit. ** irandom === End of Compilation 2 === ** grandom === End of Compilation 3 === 1501-510 Compilation successful for file random.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/rcalc.F90 > ../obj/rcalc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rcalc.o ../obj/rcalc.f ** rcalc === End of Compilation 1 === "../obj/rcalc.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file rcalc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/setprtvec.F90 > ../obj/setprtvec.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/setprtvec.o ../obj/setprtvec.f ** setprtvec === End of Compilation 1 === "../obj/setprtvec.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file setprtvec.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/setunit.F90 > ../obj/setunit.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/setunit.o ../obj/setunit.f ** setunit === End of Compilation 1 === 1501-510 Compilation successful for file setunit.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/strcatf.F90 > ../obj/strcatf.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/strcatf.o ../obj/strcatf.f ** strcatf === End of Compilation 1 === 1501-510 Compilation successful for file strcatf.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/upcase.F90 > ../obj/upcase.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/upcase.o ../obj/upcase.f ** upcase === End of Compilation 1 === 1501-510 Compilation successful for file upcase.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/updatefname.F90 > ../obj/updatefname.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/updatefname.o ../obj/updatefname.f ** updatefname === End of Compilation 1 === 1501-510 Compilation successful for file updatefname.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/wdjoin.F90 > ../obj/wdjoin.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/wdjoin.o ../obj/wdjoin.f ** wdjoin === End of Compilation 1 === 1501-510 Compilation successful for file wdjoin.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/whatis.F90 > ../obj/whatis.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/whatis.o ../obj/whatis.f ** whatis1 === End of Compilation 1 === ** whatis1i === End of Compilation 2 === ** whatis2 === End of Compilation 3 === ** whatis7 === End of Compilation 4 === 1501-510 Compilation successful for file whatis.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/util/zmake.F90 > ../obj/zmake.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/zmake.o ../obj/zmake.f "../obj/zmake.f", line 39.1: 1511-007 (W) An END DO should only be used to close one DO loop or one DO WHILE loop. ** zmake === End of Compilation 1 === "../obj/zmake.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file zmake.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/qm_mm_div.F90 > ../obj/qm_mm_div.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/qm_mm_div.o ../obj/qm_mm_div.f ** qm_mm_div === End of Compilation 1 === 1501-510 Compilation successful for file qm_mm_div.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/hcorecl.F90 > ../obj/hcorecl.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/hcorecl.o ../obj/hcorecl.f ** hcorecl === End of Compilation 1 === 1501-510 Compilation successful for file hcorecl.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/tran.F90 > ../obj/tran.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/tran.o ../obj/tran.f ** tran === End of Compilation 1 === 1501-510 Compilation successful for file tran.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/computeDimSizesqmmm.F90 > ../obj/computeDimSizesqmmm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/computeDimSizesqmmm.o ../obj/computeDimSizesqmmm.f ** computenatomsnresidues === End of Compilation 1 === ** computemsorbs === End of Compilation 2 === ** computenorbs === End of Compilation 3 === ** computepeptides === End of Compilation 4 === ** computemxatts === End of Compilation 5 === ** computemaxatres === End of Compilation 6 === 1501-510 Compilation successful for file computeDimSizesqmmm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/transd.F90 > ../obj/transd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/transd.o ../obj/transd.f ** transd === End of Compilation 1 === 1501-510 Compilation successful for file transd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/gcartcl.F90 > ../obj/gcartcl.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/gcartcl.o ../obj/gcartcl.f ** gcartcl === End of Compilation 1 === 1501-510 Compilation successful for file gcartcl.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/dcartcl.F90 > ../obj/dcartcl.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/dcartcl.o ../obj/dcartcl.f ** dcartcl === End of Compilation 1 === 1501-510 Compilation successful for file dcartcl.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/analytcl.F90 > ../obj/analytcl.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/analytcl.o ../obj/analytcl.f ** analytcl === End of Compilation 1 === "../obj/analytcl.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file analytcl.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/rotatcl.F90 > ../obj/rotatcl.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rotatcl.o ../obj/rotatcl.f ** rotatcl === End of Compilation 1 === "../obj/rotatcl.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file rotatcl.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/delricl.F90 > ../obj/delricl.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/delricl.o ../obj/delricl.f "../obj/delricl.f", line 42.12: 1514-022 (W) Variable icalcn is in or is equivalenced to a named COMMON block. Variable must only be initialized in a BLOCK DATA subprogram. ** delricl === End of Compilation 1 === "../obj/delricl.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file delricl.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/delmolcl.F90 > ../obj/delmolcl.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/delmolcl.o ../obj/delmolcl.f ** delmolcl === End of Compilation 1 === 1501-510 Compilation successful for file delmolcl.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/rotatecl.F90 > ../obj/rotatecl.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/rotatecl.o ../obj/rotatecl.f ** rotatecl === End of Compilation 1 === "../obj/rotatecl.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file rotatecl.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/reppcl.F90 > ../obj/reppcl.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/reppcl.o ../obj/reppcl.f ** reppcl === End of Compilation 1 === 1501-510 Compilation successful for file reppcl.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/initmem.F90 > ../obj/initmem.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/initmem.o ../obj/initmem.f ** initmem === End of Compilation 1 === 1501-510 Compilation successful for file initmem.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/main/energyqmmm.F90 > ../obj/energyqmmm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/energyqmmm.o ../obj/energyqmmm.f ** energy === End of Compilation 1 === 1501-510 Compilation successful for file energyqmmm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/scf/doscfqmmm.F90 > ../obj/doscfqmmm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/doscfqmmm.o ../obj/doscfqmmm.f ** doscf === End of Compilation 1 === "../obj/doscfqmmm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file doscfqmmm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/scf/fockqmmm.F90 > ../obj/fockqmmm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/fockqmmm.o ../obj/fockqmmm.f ** fock === End of Compilation 1 === "../obj/fockqmmm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file fockqmmm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/setup/commandqmmm.F90 > ../obj/commandqmmm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/commandqmmm.o ../obj/commandqmmm.f ** initializefname === End of Compilation 1 === ** readcommandline === End of Compilation 2 === 1501-510 Compilation successful for file commandqmmm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/qmmm/initmem2.F90 > ../obj/initmem2.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/initmem2.o ../obj/initmem2.f ** initmem2 === End of Compilation 1 === 1501-510 Compilation successful for file initmem2.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DHAS_LAPACK -I../src/include ../src/mem/allocateMxAtomVarsqmmm.F90 > ../obj/allocateMxAtomVarsqmmm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -I../../sander -o ../obj/allocateMxAtomVarsqmmm.o ../obj/allocateMxAtomVarsqmmm.f ** allocatemxatomvars === End of Compilation 1 === 1501-510 Compilation successful for file allocateMxAtomVarsqmmm.f. ar rvs libdivcon.a ../obj/chgRdKeys.o ../obj/ioRdKeys.o ../obj/ioRdTail.o ../obj/dcRdKeys.o ../obj/dcRdTail.o ../obj/mcRdKeys.o ../obj/minRdKeys.o ../obj/minRdTail.o ../obj/mmRdKeys.o ../obj/mmRdTail.o ../obj/nmrRdKeys.o ../obj/nmrRdTail.o ../obj/paramRdKeys.o ../obj/pbRdKeys.o ../obj/pmeRdKeys.o ../obj/scfRdKeys.o ../obj/tsRdKeys.o ../obj/atgrid.o ../obj/chkres.o ../obj/clustsub.o ../obj/cmbcore.o ../obj/cmbsub.o ../obj/doferm.o ../obj/esqr.o ../obj/esqrfdm.o ../obj/frmchk.o ../obj/fshift.o ../obj/gensub.o ../obj/gridafnc.o ../obj/gridrfnc.o ../obj/mixgrid.o ../obj/mkgrid.o ../obj/pgridafnc.o ../obj/pgridrfnc.o ../obj/resgrid.o ../obj/setncell.o ../obj/sproc.o ../obj/dc_module.o ../obj/freq.o ../obj/hsep.o ../obj/freqRdKeys.o ../obj/freqRdTail.o ../obj/freq_module.o ../obj/hamRdKeys.o ../obj/mndo_module.o ../obj/am1_module.o ../obj/pm3_module.o ../obj/mndod_module.o ../obj/pddgpm3_module.o ../obj/aijm.o ../obj/attrecurse.o ../obj/ddpo.o ../obj/diat.o ../obj/ecd.o ../obj/electricfield.o ../obj/erecursive.o ../obj/FmT.o ../obj/inighd.o ../obj/intdd1.o ../obj/intdd2.o ../obj/intdd3.o ../obj/intdd4.o ../obj/intdd5.o ../obj/intdd6.o ../obj/intdd.o ../obj/intdp.o ../obj/intds.o ../obj/intpd.o ../obj/intsd.o ../obj/localdd.o ../obj/localdp.o ../obj/localds.o ../obj/localpd.o ../obj/localsd.o ../obj/overlap.o ../obj/overlp.o ../obj/repuld.o ../obj/repul.o ../obj/sabt.o ../obj/setdorb.o ../obj/slow.o ../obj/slowi.o ../obj/intRdKeys.o ../obj/int_module.o ../obj/getversion.o ../obj/header.o ../obj/printen.o ../obj/printpar.o ../obj/printsub.o ../obj/rdcoord.o ../obj/rdbelly.o ../obj/rdbox.o ../obj/rdchemix.o ../obj/rdcluster.o ../obj/rdcomb.o ../obj/rddmx.o ../obj/rddos.o ../obj/rdgrid.o ../obj/rdgroup.o ../obj/rdguess.o ../obj/rdhess.o ../obj/rdint.o ../obj/rdkeys.o ../obj/rdlist.o ../obj/rdneighb.o ../obj/rdnext.o ../obj/rdnmr.o ../obj/rdnum.o ../obj/rdpdb.o ../obj/rdprtvec.o ../obj/rdrestraints.o ../obj/rdrst.o ../obj/rdsub.o ../obj/rdtail.o ../obj/rdvdw.o ../obj/rdword.o ../obj/rdxyz.o ../obj/wrtchg.o ../obj/wrtcoor.o ../obj/wrtdefaultkeys.o ../obj/wrtdiv.o ../obj/wrtdmx.o ../obj/wrtgrd.o ../obj/wrthss.o ../obj/wrtint.o ../obj/wrtpdb.o ../obj/wrtqma.o ../obj/wrtrep.o ../obj/wrtrst.o ../obj/wrttim.o ../obj/wrtvec.o ../obj/wrtvecsub.o ../obj/wrtxyz.o ../obj/block.o ../obj/denful.o ../obj/densub.o ../obj/densubfdm.o ../obj/divcon.o ../obj/edriver.o ../obj/global_module.o ../obj/param_module.o ../obj/math_module.o ../obj/pme_module.o ../obj/mm_module.o ../obj/nmr_module.o ../obj/mosub.o ../obj/mosubfdm.o ../obj/mosubfdmx.o ../obj/mainRdKeys.o ../obj/element_module.o ../obj/diag.o ../obj/diagp.o ../obj/fourier.o ../obj/lsolve.o ../obj/math.o ../obj/normalization.o ../obj/pdsyevd_driver.o ../obj/pdsyevx_driver.o ../obj/zheev.o ../obj/boxmove.o ../obj/boxstep.o ../obj/dovir.o ../obj/gcartmc.o ../obj/getrforc.o ../obj/mccopy.o ../obj/mcsetup.o ../obj/nptdriver.o ../obj/nvtdriver.o ../obj/resmove.o ../obj/resstep.o ../obj/rottr.o ../obj/setbox.o ../obj/submove.o ../obj/mc_module.o ../obj/allocatevars.o ../obj/deallocatevars.o ../obj/allocateDcVars.o ../obj/allocateIntVars.o ../obj/allocateMmVars.o ../obj/allocateFreqVars.o ../obj/allocateGuessVars.o ../obj/allocateMcVars.o ../obj/allocateMinVars.o ../obj/allocateNmrVars.o ../obj/allocateParamVars.o ../obj/allocatePmeVars.o ../obj/allocateScrfVars.o ../obj/allocateToolsVars.o ../obj/bsrch.o ../obj/diislb.o ../obj/diisub.o ../obj/geoopt.o ../obj/geoopt_module.o ../obj/getdir.o ../obj/lbfgs.o ../obj/linmin.o ../obj/min_module.o ../obj/getmm.o ../obj/getpep.o ../obj/ljglobals.o ../obj/ljint.o ../obj/mmroutines.o ../obj/restraint.o ../obj/mmDriver.o ../obj/balance.o ../obj/set_mpi_init.o ../obj/assignbasis.o ../obj/chshift.o ../obj/nmrdenful.o ../obj/nmrdensub.o ../obj/nmrdmx.o ../obj/nmresqr.o ../obj/oethccs.o ../obj/mndonmr_module.o ../obj/coppnt.o ../obj/error.o ../obj/loop.o ../obj/parop2.o ../obj/parop.o ../obj/recalc.o ../obj/tstpnt.o ../obj/chk_run_delphi.o ../obj/divpb.o ../obj/dpaccelerate.o ../obj/dpchargegrid.o ../obj/dpcollectsurfcharge.o ../obj/dpfinesurfprep.o ../obj/dpfinesurfacc.o ../obj/dpfinesurfrelax.o ../obj/dpgetmol.o ../obj/dpinit.o ../obj/dploop.o ../obj/dpmakegrid.o ../obj/dpmakesurface.o ../obj/dpmodule.o ../obj/dpsetepsilon.o ../obj/dpsetphi.o ../obj/nonpolar2.o ../obj/pbfock.o ../obj/pb_mds.o ../obj/pb_putpnt.o ../obj/pbsolver.o ../obj/pb_spt.o ../obj/pb_subdiv.o ../obj/pb_vector.o ../obj/pbDriver.o ../obj/pme_calcb.o ../obj/pme_calcq.o ../obj/pme_calcqmc.o ../obj/pme_calctheta.o ../obj/pme_derec.o ../obj/pme_derecmc.o ../obj/pme_direct.o ../obj/pme_directmc.o ../obj/pme_erec.o ../obj/pme_erecmc.o ../obj/pme_recip.o ../obj/pme_recipmc.o ../obj/pme_setup.o ../obj/pmeDriver.o ../obj/fmix.o ../obj/escf.o ../obj/initp.o ../obj/pmix.o ../obj/scf_module.o ../obj/assign.o ../obj/atmlist.o ../obj/glbpnt.o ../obj/initializeVars.o ../obj/intpr.o ../obj/setdef.o ../obj/setname2.o ../obj/setopt.o ../obj/setup.o ../obj/stripkeywd.o ../obj/atmchg.o ../obj/bcheck.o ../obj/dipole.o ../obj/homolumo.o ../obj/mkdos.o ../obj/push.o ../obj/pwdecomp.o ../obj/rotate.o ../obj/thermo.o ../obj/toolsRdKeys.o ../obj/toolsRdTail.o ../obj/tools_module.o ../obj/toolsDriver.o ../obj/rderror.o ../obj/error_module.o ../obj/geots.o ../obj/prjfc.o ../obj/septs.o ../obj/tsqna.o ../obj/tsrfo.o ../obj/ts_module.o ../obj/av.o ../obj/binloc_index.o ../obj/bleng.o ../obj/bndang.o ../obj/bpair.o ../obj/bsort.o ../obj/bspline.o ../obj/calcgeo.o ../obj/chkovlp.o ../obj/diffp_stat.o ../obj/dihedr.o ../obj/dograd.o ../obj/etimer.o ../obj/g2int.o ../obj/gcart.o ../obj/getcrd.o ../obj/getpar2.o ../obj/getpar.o ../obj/getxyz.o ../obj/icoord.o ../obj/ijpair.o ../obj/mcweeny.o ../obj/mvcrd.o ../obj/namemcf.o ../obj/oned.o ../obj/opnfil.o ../obj/out2stream.o ../obj/out2xml.o ../obj/pbcxyz.o ../obj/random.o ../obj/rcalc.o ../obj/save_module.o ../obj/setprtvec.o ../obj/setunit.o ../obj/strcatf.o ../obj/upcase.o ../obj/updatefname.o ../obj/wdjoin.o ../obj/whatis.o ../obj/zmake.o ../obj/qm_mm_div.o ../obj/hcorecl.o ../obj/tran.o ../obj/computeDimSizesqmmm.o ../obj/transd.o ../obj/gcartcl.o ../obj/dcartcl.o ../obj/analytcl.o ../obj/rotatcl.o ../obj/delricl.o ../obj/delmolcl.o ../obj/rotatecl.o ../obj/reppcl.o ../obj/initmem.o ../obj/energyqmmm.o ../obj/doscfqmmm.o ../obj/fockqmmm.o ../obj/commandqmmm.o ../obj/initmem2.o ../obj/allocateMxAtomVarsqmmm.o ar: creating archive libdivcon.a a - ../obj/chgRdKeys.o a - ../obj/ioRdKeys.o a - ../obj/ioRdTail.o a - ../obj/dcRdKeys.o a - ../obj/dcRdTail.o a - ../obj/mcRdKeys.o a - ../obj/minRdKeys.o a - ../obj/minRdTail.o a - ../obj/mmRdKeys.o a - ../obj/mmRdTail.o a - ../obj/nmrRdKeys.o a - ../obj/nmrRdTail.o a - ../obj/paramRdKeys.o a - ../obj/pbRdKeys.o a - ../obj/pmeRdKeys.o a - ../obj/scfRdKeys.o a - ../obj/tsRdKeys.o a - ../obj/atgrid.o a - ../obj/chkres.o a - ../obj/clustsub.o a - ../obj/cmbcore.o a - ../obj/cmbsub.o a - ../obj/doferm.o a - ../obj/esqr.o a - ../obj/esqrfdm.o a - ../obj/frmchk.o a - ../obj/fshift.o a - ../obj/gensub.o a - ../obj/gridafnc.o a - ../obj/gridrfnc.o a - ../obj/mixgrid.o a - ../obj/mkgrid.o a - ../obj/pgridafnc.o a - ../obj/pgridrfnc.o a - ../obj/resgrid.o a - ../obj/setncell.o a - ../obj/sproc.o a - ../obj/dc_module.o a - ../obj/freq.o a - ../obj/hsep.o a - ../obj/freqRdKeys.o a - ../obj/freqRdTail.o a - ../obj/freq_module.o a - ../obj/hamRdKeys.o a - ../obj/mndo_module.o a - ../obj/am1_module.o a - ../obj/pm3_module.o a - ../obj/mndod_module.o a - ../obj/pddgpm3_module.o a - ../obj/aijm.o a - ../obj/attrecurse.o a - ../obj/ddpo.o a - ../obj/diat.o a - ../obj/ecd.o a - ../obj/electricfield.o a - ../obj/erecursive.o a - ../obj/FmT.o a - ../obj/inighd.o a - ../obj/intdd1.o a - ../obj/intdd2.o a - ../obj/intdd3.o a - ../obj/intdd4.o a - ../obj/intdd5.o a - ../obj/intdd6.o a - ../obj/intdd.o a - ../obj/intdp.o a - ../obj/intds.o a - ../obj/intpd.o a - ../obj/intsd.o a - ../obj/localdd.o a - ../obj/localdp.o a - ../obj/localds.o a - ../obj/localpd.o a - ../obj/localsd.o a - ../obj/overlap.o a - ../obj/overlp.o a - ../obj/repuld.o a - ../obj/repul.o a - ../obj/sabt.o a - ../obj/setdorb.o a - ../obj/slow.o a - ../obj/slowi.o a - ../obj/intRdKeys.o a - ../obj/int_module.o a - ../obj/getversion.o a - ../obj/header.o a - ../obj/printen.o a - ../obj/printpar.o a - ../obj/printsub.o a - ../obj/rdcoord.o a - ../obj/rdbelly.o a - ../obj/rdbox.o a - ../obj/rdchemix.o a - ../obj/rdcluster.o a - ../obj/rdcomb.o a - ../obj/rddmx.o a - ../obj/rddos.o a - ../obj/rdgrid.o a - ../obj/rdgroup.o a - ../obj/rdguess.o a - ../obj/rdhess.o a - ../obj/rdint.o a - ../obj/rdkeys.o a - ../obj/rdlist.o a - ../obj/rdneighb.o a - ../obj/rdnext.o a - ../obj/rdnmr.o a - ../obj/rdnum.o a - ../obj/rdpdb.o a - ../obj/rdprtvec.o a - ../obj/rdrestraints.o a - ../obj/rdrst.o a - ../obj/rdsub.o a - ../obj/rdtail.o a - ../obj/rdvdw.o a - ../obj/rdword.o a - ../obj/rdxyz.o a - ../obj/wrtchg.o a - ../obj/wrtcoor.o a - ../obj/wrtdefaultkeys.o a - ../obj/wrtdiv.o a - ../obj/wrtdmx.o a - ../obj/wrtgrd.o a - ../obj/wrthss.o a - ../obj/wrtint.o a - ../obj/wrtpdb.o a - ../obj/wrtqma.o a - ../obj/wrtrep.o a - ../obj/wrtrst.o a - ../obj/wrttim.o a - ../obj/wrtvec.o a - ../obj/wrtvecsub.o a - ../obj/wrtxyz.o a - ../obj/block.o a - ../obj/denful.o a - ../obj/densub.o a - ../obj/densubfdm.o a - ../obj/divcon.o a - ../obj/edriver.o a - ../obj/global_module.o a - ../obj/param_module.o a - ../obj/math_module.o a - ../obj/pme_module.o a - ../obj/mm_module.o a - ../obj/nmr_module.o a - ../obj/mosub.o a - ../obj/mosubfdm.o a - ../obj/mosubfdmx.o a - ../obj/mainRdKeys.o a - ../obj/element_module.o a - ../obj/diag.o a - ../obj/diagp.o a - ../obj/fourier.o a - ../obj/lsolve.o a - ../obj/math.o a - ../obj/normalization.o a - ../obj/pdsyevd_driver.o a - ../obj/pdsyevx_driver.o a - ../obj/zheev.o a - ../obj/boxmove.o a - ../obj/boxstep.o a - ../obj/dovir.o a - ../obj/gcartmc.o a - ../obj/getrforc.o a - ../obj/mccopy.o a - ../obj/mcsetup.o a - ../obj/nptdriver.o a - ../obj/nvtdriver.o a - ../obj/resmove.o a - ../obj/resstep.o a - ../obj/rottr.o a - ../obj/setbox.o a - ../obj/submove.o a - ../obj/mc_module.o a - ../obj/allocatevars.o a - ../obj/deallocatevars.o a - ../obj/allocateDcVars.o a - ../obj/allocateIntVars.o a - ../obj/allocateMmVars.o a - ../obj/allocateFreqVars.o a - ../obj/allocateGuessVars.o a - ../obj/allocateMcVars.o a - ../obj/allocateMinVars.o a - ../obj/allocateNmrVars.o a - ../obj/allocateParamVars.o a - ../obj/allocatePmeVars.o a - ../obj/allocateScrfVars.o a - ../obj/allocateToolsVars.o a - ../obj/bsrch.o a - ../obj/diislb.o a - ../obj/diisub.o a - ../obj/geoopt.o a - ../obj/geoopt_module.o a - ../obj/getdir.o a - ../obj/lbfgs.o a - ../obj/linmin.o a - ../obj/min_module.o a - ../obj/getmm.o a - ../obj/getpep.o a - ../obj/ljglobals.o a - ../obj/ljint.o a - ../obj/mmroutines.o a - ../obj/restraint.o a - ../obj/mmDriver.o a - ../obj/balance.o a - ../obj/set_mpi_init.o a - ../obj/assignbasis.o a - ../obj/chshift.o a - ../obj/nmrdenful.o a - ../obj/nmrdensub.o a - ../obj/nmrdmx.o a - ../obj/nmresqr.o a - ../obj/oethccs.o a - ../obj/mndonmr_module.o a - ../obj/coppnt.o a - ../obj/error.o a - ../obj/loop.o a - ../obj/parop2.o a - ../obj/parop.o a - ../obj/recalc.o a - ../obj/tstpnt.o a - ../obj/chk_run_delphi.o a - ../obj/divpb.o a - ../obj/dpaccelerate.o a - ../obj/dpchargegrid.o a - ../obj/dpcollectsurfcharge.o a - ../obj/dpfinesurfprep.o a - ../obj/dpfinesurfacc.o a - ../obj/dpfinesurfrelax.o a - ../obj/dpgetmol.o a - ../obj/dpinit.o a - ../obj/dploop.o a - ../obj/dpmakegrid.o a - ../obj/dpmakesurface.o a - ../obj/dpmodule.o a - ../obj/dpsetepsilon.o a - ../obj/dpsetphi.o a - ../obj/nonpolar2.o a - ../obj/pbfock.o a - ../obj/pb_mds.o a - ../obj/pb_putpnt.o a - ../obj/pbsolver.o a - ../obj/pb_spt.o a - ../obj/pb_subdiv.o a - ../obj/pb_vector.o a - ../obj/pbDriver.o a - ../obj/pme_calcb.o a - ../obj/pme_calcq.o a - ../obj/pme_calcqmc.o a - ../obj/pme_calctheta.o a - ../obj/pme_derec.o a - ../obj/pme_derecmc.o a - ../obj/pme_direct.o a - ../obj/pme_directmc.o a - ../obj/pme_erec.o a - ../obj/pme_erecmc.o a - ../obj/pme_recip.o a - ../obj/pme_recipmc.o a - ../obj/pme_setup.o a - ../obj/pmeDriver.o a - ../obj/fmix.o a - ../obj/escf.o a - ../obj/initp.o a - ../obj/pmix.o a - ../obj/scf_module.o a - ../obj/assign.o a - ../obj/atmlist.o a - ../obj/glbpnt.o a - ../obj/initializeVars.o a - ../obj/intpr.o a - ../obj/setdef.o a - ../obj/setname2.o a - ../obj/setopt.o a - ../obj/setup.o a - ../obj/stripkeywd.o a - ../obj/atmchg.o a - ../obj/bcheck.o a - ../obj/dipole.o a - ../obj/homolumo.o a - ../obj/mkdos.o a - ../obj/push.o a - ../obj/pwdecomp.o a - ../obj/rotate.o a - ../obj/thermo.o a - ../obj/toolsRdKeys.o a - ../obj/toolsRdTail.o a - ../obj/tools_module.o a - ../obj/toolsDriver.o a - ../obj/rderror.o a - ../obj/error_module.o a - ../obj/geots.o a - ../obj/prjfc.o a - ../obj/septs.o a - ../obj/tsqna.o a - ../obj/tsrfo.o a - ../obj/ts_module.o a - ../obj/av.o a - ../obj/binloc_index.o a - ../obj/bleng.o a - ../obj/bndang.o a - ../obj/bpair.o a - ../obj/bsort.o a - ../obj/bspline.o a - ../obj/calcgeo.o a - ../obj/chkovlp.o a - ../obj/diffp_stat.o a - ../obj/dihedr.o a - ../obj/dograd.o a - ../obj/etimer.o a - ../obj/g2int.o a - ../obj/gcart.o a - ../obj/getcrd.o a - ../obj/getpar2.o a - ../obj/getpar.o a - ../obj/getxyz.o a - ../obj/icoord.o a - ../obj/ijpair.o a - ../obj/mcweeny.o a - ../obj/mvcrd.o a - ../obj/namemcf.o a - ../obj/oned.o a - ../obj/opnfil.o a - ../obj/out2stream.o a - ../obj/out2xml.o a - ../obj/pbcxyz.o a - ../obj/random.o a - ../obj/rcalc.o a - ../obj/save_module.o a - ../obj/setprtvec.o a - ../obj/setunit.o a - ../obj/strcatf.o a - ../obj/upcase.o a - ../obj/updatefname.o a - ../obj/wdjoin.o a - ../obj/whatis.o a - ../obj/zmake.o a - ../obj/qm_mm_div.o a - ../obj/hcorecl.o a - ../obj/tran.o a - ../obj/computeDimSizesqmmm.o a - ../obj/transd.o a - ../obj/gcartcl.o a - ../obj/dcartcl.o a - ../obj/analytcl.o a - ../obj/rotatcl.o a - ../obj/delricl.o a - ../obj/delmolcl.o a - ../obj/rotatecl.o a - ../obj/reppcl.o a - ../obj/initmem.o a - ../obj/energyqmmm.o a - ../obj/doscfqmmm.o a - ../obj/fockqmmm.o a - ../obj/commandqmmm.o a - ../obj/initmem2.o a - ../obj/allocateMxAtomVarsqmmm.o ranlib libdivcon.a mv libdivcon.a ../src/qmmm/ xlf90 -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfree=f90 -o sander evb_vars.o evb_input.o evb_init.o evb_alloc.o evb_dealloc.o check_input.o evb_io.o evb_keywrd.o exchange_CM.o evb_mcp.o evb_force.o diabatic.o evb_2stdebug.o egap_umb_2stdebug.o exchange_gauss.o exchange_warshel.o morsify.o morse_anal2num.o evb_matrix.o evb_ntrfc.o out_evb.o constants.o stack.o qmmm_module.o trace.o lmod.o decomp.o icosasurf.o egb.o findmask.o pb_force.o pb_exmol.o pb_mpfrc.o pb_direct.o pb_list.o np_force.o sa_driver.o relax_mat.o nmr.o multisander.o sander.o trajene.o cshf.o nmrcal.o pearsn.o printe.o runmin.o rdparm.o mdread.o locmem.o runmd.o getcor.o degcnt.o decnvh.o fastwt.o parallel.o shake.o ene.o mdwrit.o minrit.o set.o dynlib.o mdfil.o nmlsrc.o ew_force.o ew_setup.o ew_box.o ew_bspline.o ew_fft.o nonbond_list.o short_ene.o ew_recip.o pcshift.o align.o rfree.o rgroup.o random.o amopen.o debug.o ew_recip_reg.o ew_handle_dips.o ew_dipole_recip.o mexit.o new_time.o extra_pts.o thermo_int.o matinv.o assert.o mmtsb.o mmtsb_client.o erfcfun.o veclib.o is_init.o constantph.o prn_dipoles.o ips.o sglds.o amoeba_valence.o amoeba_multipoles.o amoeba_recip.o amoeba_interface.o amoeba_direct.o amoeba_mdin.o amoeba_adjust.o amoeba_self.o amoeba_vdw.o amoeba_induced.o amoeba_runmd.o bintraj.o spatial_recip.o spatial_fft.o parms.o qm_mm.o qm_link_atoms.o qm_nb_list.o qm_extract_coords.o qm_ewald.o qm_gb.o qm_zero_charges.o qm_print_info.o qm_assign_atom_types.o qm2_allocate_e_repul.o qm2_calc_charges.o qm2_calc_rij_and_eqns.o qm2_dihed.o qm2_energy.o qm2_fock.o qm2_get_qm_forces.o qm2_get_qmmm_forces.o qm2_h1elec.o qm2_hcore_qmqm.o qm2_hcore_qmmm.o qm2_identify_peptide_links.o qm2_load_params_and_allocate.o qm2_repp.o qm2_rotate_qmqm.o qm2_scf.o qm2_setup_orb_exp.o qm2_smallest_number.o qm2_dftb_module.o qm2_dftb_broyden.o qm2_dftb_dispersion_egr.o qm2_dftb_dispersion_params.o qm2_dftb_dispersionread.o qm2_dftb_eglcao.o qm2_dftb_energy.o qm2_dftb_ewevge.o qm2_dftb_externalchgrad.o qm2_dftb_externalshift.o qm2_dftb_fermi.o qm2_dftb_forces.o qm2_dftb_gamma.o qm2_dftb_gammamat.o qm2_dftb_get_qmmm_forces.o qm2_dftb_gettab.o qm2_dftb_load_params.o qm2_dftb_long_range.o qm2_dftb_main.o qm2_dftb_my_gradient.o qm2_dftb_my_mulliken.o qm2_dftb_repulsiv.o qm2_dftb_self.o qm2_dftb_shift.o qm2_dftb_short_range.o qm2_dftb_skpar.o qm2_dftb_slkode.o qm2_dftb_slktrafo.o \ qm_div.o force.o \ ../lmod/lmod.a ../dcqtp/src/qmmm/libdivcon.a \ ../lapack/lapack.a ../blas/blas.a \ ../lib/nxtsec.o ../lib/sys.a -Wl,-framework -Wl,Accelerate /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES egb.f > _egb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o egb.LES.o _egb.f ** genborn === End of Compilation 1 === "_egb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _egb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES nmr.f > _nmr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o nmr.LES.o _nmr.f ** nmr === End of Compilation 1 === "_nmr.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _nmr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES ew_recip.f > _ew_recip.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_recip.LES.o _ew_recip.f ** ew_recip === End of Compilation 1 === "_ew_recip.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_recip.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES sander.f > _sander.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o sander.LES.o _sander.f ** sander === End of Compilation 1 === ** esp === End of Compilation 2 === 1501-510 Compilation successful for file _sander.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES force.f > _force.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o force.LES.o _force.f ** force === End of Compilation 1 === ** evb_amber_alloc === End of Compilation 2 === ** evb_amber_dealloc === End of Compilation 3 === "_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _force.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES rdparm.f > _rdparm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o rdparm.LES.o _rdparm.f ** rdparm1 === End of Compilation 1 === ** rdparm2 === End of Compilation 2 === ** istuff === End of Compilation 3 === 1501-510 Compilation successful for file _rdparm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES mdread.f > _mdread.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o mdread.LES.o _mdread.f ** mdread1 === End of Compilation 1 === ** cnstphread === End of Compilation 2 === ** mdread2 === End of Compilation 3 === ** printflags === End of Compilation 4 === ** printflags2 === End of Compilation 5 === ** float_legal_range === End of Compilation 6 === ** int_legal_range === End of Compilation 7 === ** opt_legal_range === End of Compilation 8 === ** sander_bomb === End of Compilation 9 === 1501-510 Compilation successful for file _mdread.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES locmem.f > _locmem.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o locmem.LES.o _locmem.f ** locmem === End of Compilation 1 === ** adj_mem_ptr === End of Compilation 2 === 1501-510 Compilation successful for file _locmem.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES runmd.f > _runmd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o runmd.LES.o _runmd.f ** runmd === End of Compilation 1 === ** quench === End of Compilation 2 === "_runmd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_runmd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _runmd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES degcnt.f > _degcnt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o degcnt.LES.o _degcnt.f ** degcnt === End of Compilation 1 === "_degcnt.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _degcnt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES parallel.f > _parallel.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o parallel.LES.o _parallel.f ** dummy_parallel === End of Compilation 1 === 1501-510 Compilation successful for file _parallel.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES ene.f > _ene.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ene.LES.o _ene.f ** bond === End of Compilation 1 === ** angl === End of Compilation 2 === ** ephi === End of Compilation 3 === ** capwat === End of Compilation 4 === ** xconst === End of Compilation 5 === ** xtgtmd === End of Compilation 6 === ** rmsfit === End of Compilation 7 === ** bellyf === End of Compilation 8 === "_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ene.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES dynlib.f > _dynlib.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o dynlib.LES.o _dynlib.f ** corpac === End of Compilation 1 === ** ekcmr === End of Compilation 2 === ** open_dump_files === End of Compilation 3 === ** close_dump_files === End of Compilation 4 === ** prntmd === End of Compilation 5 === ** setvel === End of Compilation 6 === ** mdeng === End of Compilation 7 === ** mden2 === End of Compilation 8 === ** cenmas === End of Compilation 9 === ** stopcm === End of Compilation 10 === "_dynlib.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_dynlib.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_dynlib.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_dynlib.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dynlib.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES ew_force.f > _ew_force.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_force.LES.o _ew_force.f ** ewald_force === End of Compilation 1 === ** do_pme_recip === End of Compilation 2 === ** force_info === End of Compilation 3 === ** get_nonbond_virial === End of Compilation 4 === ** nb_adjust === End of Compilation 5 === ** nb_adjust_dipole === End of Compilation 6 === ** self === End of Compilation 7 === ** self_dipole === End of Compilation 8 === ** dip_field_corr === End of Compilation 9 === ** respa_scale === End of Compilation 10 === ** nb_adjust_les === End of Compilation 11 === "_ew_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_force.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES short_ene.f > _short_ene.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o short_ene.LES.o _short_ene.f ** get_nb_energy === End of Compilation 1 === ** short_ene === End of Compilation 2 === ** short_ene_dip === End of Compilation 3 === "_short_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_short_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _short_ene.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES extra_pts.f > _extra_pts.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o extra_pts.LES.o _extra_pts.f ** init_extra_pts1 === End of Compilation 1 === ** init_extra_pts === End of Compilation 2 === ** get_nghbrs === End of Compilation 3 === ** define_frames === End of Compilation 4 === ** local_to_global === End of Compilation 5 === ** do_local_global === End of Compilation 6 === ** orient_frc === End of Compilation 7 === ** do_orient_frc === End of Compilation 8 === ** fill_bonded === End of Compilation 9 === ** sort_pairs === End of Compilation 10 === ** redo_masked === End of Compilation 11 === ** add_one_list_iblo === End of Compilation 12 === ** add_one_list_inb === End of Compilation 13 === ** build_14nb === End of Compilation 14 === ** get_14_cg === End of Compilation 15 === ** do_14_cg === End of Compilation 16 === ** get_14_dipole === End of Compilation 17 === ** do_14_dipole === End of Compilation 18 === ** fix_masses === End of Compilation 19 === ** trim_bonds === End of Compilation 20 === ** trim_theta === End of Compilation 21 === ** trim_phi === End of Compilation 22 === ** fix_degree_count === End of Compilation 23 === ** allocate_14nb === End of Compilation 24 === ** copy_14nb === End of Compilation 25 === ** allocate_frames === End of Compilation 26 === ** do_pairs === End of Compilation 27 === ** do_14pairs === End of Compilation 28 === "_extra_pts.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_extra_pts.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_extra_pts.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _extra_pts.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD pimd_vars.f > _pimd_vars.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o pimd_vars.PIMD.o _pimd_vars.f ** pimd_vars === End of Compilation 1 === 1501-510 Compilation successful for file _pimd_vars.f. xlf90 -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfree=f90 -o sander.LES evb_vars.o evb_input.o evb_init.o evb_alloc.o evb_dealloc.o check_input.o evb_io.o evb_keywrd.o exchange_CM.o evb_mcp.o evb_force.o diabatic.o evb_2stdebug.o egap_umb_2stdebug.o exchange_gauss.o exchange_warshel.o morsify.o morse_anal2num.o evb_matrix.o evb_ntrfc.o out_evb.o constants.o qmmm_module.o trace.o lmod.o decomp.o icosasurf.o egb.LES.o findmask.o pb_force.o pb_exmol.o pb_mpfrc.o pb_direct.o pb_list.o np_force.o sa_driver.o relax_mat.o nmr.LES.o multisander.o sander.LES.o trajene.o cshf.o nmrcal.o pearsn.o printe.o runmin.o nonbond_list.o force.LES.o rdparm.LES.o mdread.LES.o locmem.LES.o runmd.LES.o getcor.o degcnt.LES.o decnvh.o fastwt.o parallel.LES.o shake.o ene.LES.o mdwrit.o minrit.o set.o dynlib.LES.o mdfil.o nmlsrc.o ew_force.LES.o ew_setup.o ew_box.o ew_bspline.o ew_fft.o short_ene.LES.o ew_recip.LES.o pcshift.o align.o stack.o rfree.o rgroup.o random.o amopen.o debug.o ew_recip_reg.o ew_handle_dips.o ew_dipole_recip.o mexit.o new_time.o extra_pts.LES.o thermo_int.o matinv.o assert.o mmtsb.o mmtsb_client.o erfcfun.o veclib.o is_init.o constantph.o prn_dipoles.o ips.o sglds.o qm_mm.o qm_link_atoms.o qm_nb_list.o qm_extract_coords.o qm_ewald.o qm_gb.o qm_zero_charges.o qm_print_info.o qm_assign_atom_types.o qm2_allocate_e_repul.o qm2_calc_charges.o qm2_calc_rij_and_eqns.o qm2_dihed.o qm2_energy.o qm2_fock.o qm2_get_qm_forces.o qm2_get_qmmm_forces.o qm2_h1elec.o qm2_hcore_qmqm.o qm2_hcore_qmmm.o qm2_identify_peptide_links.o qm2_load_params_and_allocate.o qm2_repp.o qm2_rotate_qmqm.o qm2_scf.o qm2_setup_orb_exp.o qm2_smallest_number.o qm2_dftb_module.o qm2_dftb_broyden.o qm2_dftb_dispersion_egr.o qm2_dftb_dispersion_params.o qm2_dftb_dispersionread.o qm2_dftb_eglcao.o qm2_dftb_energy.o qm2_dftb_ewevge.o qm2_dftb_externalchgrad.o qm2_dftb_externalshift.o qm2_dftb_fermi.o qm2_dftb_forces.o qm2_dftb_gamma.o qm2_dftb_gammamat.o qm2_dftb_get_qmmm_forces.o qm2_dftb_gettab.o qm2_dftb_load_params.o qm2_dftb_long_range.o qm2_dftb_main.o qm2_dftb_my_gradient.o qm2_dftb_my_mulliken.o qm2_dftb_repulsiv.o qm2_dftb_self.o qm2_dftb_shift.o qm2_dftb_short_range.o qm2_dftb_skpar.o qm2_dftb_slkode.o qm2_dftb_slktrafo.o amoeba_valence.o amoeba_multipoles.o amoeba_recip.o amoeba_interface.o amoeba_direct.o amoeba_mdin.o amoeba_adjust.o amoeba_self.o amoeba_vdw.o amoeba_induced.o amoeba_runmd.o bintraj.o spatial_recip.o spatial_fft.o pimd_vars.PIMD.o parms.o \ ../lmod/lmod.a ../lapack/lapack.a ../blas/blas.a \ ../lib/nxtsec.o ../lib/sys.a -Wl,-framework -Wl,Accelerate /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ambmask.f > _ambmask.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o ambmask.o _ambmask.f ** testambermask === End of Compilation 1 === ** getdim === End of Compilation 2 === ** getnam === End of Compilation 3 === ** getcor === End of Compilation 4 === ** genatlist === End of Compilation 5 === ** skipspaceandflush === End of Compilation 6 === ** genpdb === End of Compilation 7 === ** gengroupinput === End of Compilation 8 === 1501-510 Compilation successful for file _ambmask.f. cd ../lib; make mexit.o make[2]: `mexit.o' is up to date. xlf90 -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfree=f90 -o ambmask ambmask.o findmask.o \ amopen.o ../lib/mexit.o ../lib/nxtsec.o -Wl,-framework -Wl,Accelerate /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD qmmm_module.f > _qmmm_module.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qmmm_module.PIMD.o _qmmm_module.f ** qmmm_module === End of Compilation 1 === 1501-510 Compilation successful for file _qmmm_module.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD qm_link_atoms.f > _qm_link_atoms.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_link_atoms.PIMD.o _qm_link_atoms.f ** identify_link_atoms === End of Compilation 1 === ** position_link_atoms === End of Compilation 2 === ** distribute_lnk_f === End of Compilation 3 === ** print_link_atom_info === End of Compilation 4 === ** adj_mm_link_pair_crd === End of Compilation 5 === ** rst_mm_link_pair_crd === End of Compilation 6 === ** qmsort_link_pairs === End of Compilation 7 === 1501-510 Compilation successful for file _qm_link_atoms.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD qm_nb_list.f > _qm_nb_list.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_nb_list.PIMD.o _qm_nb_list.f ** qm_nb_list_allqm === End of Compilation 1 === 1501-510 Compilation successful for file _qm_nb_list.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD qm_mm.f > _qm_mm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o qm_mm.PIMD.o _qm_mm.f ** qm_mm === End of Compilation 1 === ** qm_get_boundbox === End of Compilation 2 === ** qm_check_periodic === End of Compilation 3 === ** qm_fill_qm_xcrd === End of Compilation 4 === ** qm_fill_qm_xcrd_periodic === End of Compilation 5 === "_qm_mm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm_mm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_qm_mm.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _qm_mm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD pimd_init.f > _pimd_init.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o pimd_init.PIMD.o _pimd_init.f ** pimd_init_params === End of Compilation 1 === ** deallocate_pimd === End of Compilation 2 === 1501-510 Compilation successful for file _pimd_init.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD pimd_force.f > _pimd_force.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o pimd_force.PIMD.o _pimd_force.f ** pimd_spring_force === End of Compilation 1 === ** dispatch === End of Compilation 2 === ** rotate === End of Compilation 3 === ** dispatch3 === End of Compilation 4 === ** normalize === End of Compilation 5 === ** pimd_neb_forces === End of Compilation 6 === ** pimd_neb_energy_report === End of Compilation 7 === 1501-510 Compilation successful for file _pimd_force.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD dynlib.f > _dynlib.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o dynlib.PIMD.o _dynlib.f ** corpac === End of Compilation 1 === ** ekcmr === End of Compilation 2 === ** open_dump_files === End of Compilation 3 === ** close_dump_files === End of Compilation 4 === ** prntmd === End of Compilation 5 === ** setvel === End of Compilation 6 === ** mdeng === End of Compilation 7 === ** mden2 === End of Compilation 8 === ** cenmas === End of Compilation 9 === ** stopcm === End of Compilation 10 === "_dynlib.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_dynlib.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_dynlib.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dynlib.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD nonbond_list.f > _nonbond_list.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o nonbond_list.PIMD.o _nonbond_list.f ** nblist === End of Compilation 1 === "_nonbond_list.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _nonbond_list.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD ew_force.f > _ew_force.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_force.PIMD.o _ew_force.f ** ewald_force === End of Compilation 1 === ** assign_copy_charge === End of Compilation 2 === ** do_pme_recip === End of Compilation 3 === ** force_info === End of Compilation 4 === ** get_nonbond_virial === End of Compilation 5 === ** nb_adjust === End of Compilation 6 === ** nb_adjust_dipole === End of Compilation 7 === ** self === End of Compilation 8 === ** self_dipole === End of Compilation 9 === ** dip_field_corr === End of Compilation 10 === ** respa_scale === End of Compilation 11 === "_ew_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_force.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD egb.f > _egb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o egb.PIMD.o _egb.f ** genborn === End of Compilation 1 === "_egb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _egb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD evb_ntrfc.f > _evb_ntrfc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o evb_ntrfc.PIMD.o _evb_ntrfc.f ** ntrfc_evb === End of Compilation 1 === 1501-510 Compilation successful for file _evb_ntrfc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD evb_pimd_init.f > _evb_pimd_init.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o evb_pimd_init.PIMD.o _evb_pimd_init.f ** evb_pimd === End of Compilation 1 === 1501-510 Compilation successful for file _evb_pimd_init.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD force.f > _force.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o force.PIMD.o _force.f ** force === End of Compilation 1 === ** evb_amber_alloc === End of Compilation 2 === ** evb_amber_dealloc === End of Compilation 3 === "_force.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _force.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD mdread.f > _mdread.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o mdread.PIMD.o _mdread.f ** mdread1 === End of Compilation 1 === ** cnstphread === End of Compilation 2 === ** mdread2 === End of Compilation 3 === ** printflags === End of Compilation 4 === ** printflags2 === End of Compilation 5 === ** float_legal_range === End of Compilation 6 === ** int_legal_range === End of Compilation 7 === ** opt_legal_range === End of Compilation 8 === ** sander_bomb === End of Compilation 9 === 1501-510 Compilation successful for file _mdread.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD rdparm.f > _rdparm.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o rdparm.PIMD.o _rdparm.f ** rdparm1 === End of Compilation 1 === ** rdparm2 === End of Compilation 2 === ** istuff === End of Compilation 3 === 1501-510 Compilation successful for file _rdparm.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD runmd.f > _runmd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o runmd.PIMD.o _runmd.f ** runmd === End of Compilation 1 === ** quench === End of Compilation 2 === "_runmd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_runmd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _runmd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD sander.f > _sander.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o sander.PIMD.o _sander.f ** sander === End of Compilation 1 === ** esp === End of Compilation 2 === 1501-510 Compilation successful for file _sander.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD short_ene.f > _short_ene.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o short_ene.PIMD.o _short_ene.f ** get_nb_energy === End of Compilation 1 === ** short_ene === End of Compilation 2 === ** short_ene_dip === End of Compilation 3 === "_short_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_short_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _short_ene.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD ew_setup.f > _ew_setup.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ew_setup.PIMD.o _ew_setup.f ** assign_ind === End of Compilation 1 === ** check_neutral === End of Compilation 2 === ** init_coulomb_switch === End of Compilation 3 === ** test_prime_factors === End of Compilation 4 === ** check_prime_factors === End of Compilation 5 === ** compute_nfft === End of Compilation 6 === ** cubspl === End of Compilation 7 === ** eed_table_mem === End of Compilation 8 === ** ewald_mem === End of Compilation 9 === ** ew_startup === End of Compilation 10 === ** fill_eed_table === End of Compilation 11 === ** find_ewaldcof === End of Compilation 12 === ** load_adj_mask === End of Compilation 13 === ** load_ewald_info === End of Compilation 14 === ** load_list_mask === End of Compilation 15 === ** loc_nb_mem === End of Compilation 16 === ** print_sz === End of Compilation 17 === ** local_nb_get_sizes === End of Compilation 18 === ** mpole_mem === End of Compilation 19 === ** pme_mem === End of Compilation 20 === ** pmesh_kspace_get_sizes === End of Compilation 21 === ** pmesh_kspace_setup === End of Compilation 22 === ** peek_ewald_inpcrd === End of Compilation 23 === ** read_ewald === End of Compilation 24 === ** vdw_correct_setup === End of Compilation 25 === ** vdw_correction === End of Compilation 26 === ** zero_array === End of Compilation 27 === ** array_copy === End of Compilation 28 === "_ew_setup.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ew_setup.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ew_setup.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD parallel.f > _parallel.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o parallel.PIMD.o _parallel.f ** dummy_parallel === End of Compilation 1 === 1501-510 Compilation successful for file _parallel.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD ene.f > _ene.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o ene.PIMD.o _ene.f ** bond === End of Compilation 1 === ** angl === End of Compilation 2 === ** ephi === End of Compilation 3 === ** capwat === End of Compilation 4 === ** xconst === End of Compilation 5 === ** xtgtmd === End of Compilation 6 === ** rmsfit === End of Compilation 7 === ** bellyf === End of Compilation 8 === "_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_ene.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ene.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD evb_matrix.f > _evb_matrix.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o evb_matrix.PIMD.o _evb_matrix.f ** evb_matrix === End of Compilation 1 === ** evb_mat_type_alloc === End of Compilation 2 === ** evb_mat_type_dealloc === End of Compilation 3 === 1501-510 Compilation successful for file _evb_matrix.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DPIMD out_evb.f > _out_evb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -o out_evb.PIMD.o _out_evb.f ** out_evb === End of Compilation 1 === 1501-510 Compilation successful for file _out_evb.f. xlf90 -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfree=f90 -o sander.PIMD parms.o constants.o qmmm_module.PIMD.o qm_link_atoms.PIMD.o qm_nb_list.PIMD.o qm_mm.PIMD.o pimd_vars.PIMD.o pimd_init.PIMD.o pimd_force.PIMD.o dynlib.PIMD.o ew_force.PIMD.o force.PIMD.o mdread.PIMD.o nonbond_list.PIMD.o rdparm.PIMD.o runmd.PIMD.o sander.PIMD.o short_ene.PIMD.o ew_setup.PIMD.o trace.o lmod.o decomp.o icosasurf.o egb.PIMD.o findmask.o pb_force.o pb_exmol.o pb_mpfrc.o pb_direct.o pb_list.o np_force.o sa_driver.o relax_mat.o nmr.LES.o multisander.o trajene.o cshf.o nmrcal.o pearsn.o printe.o runmin.o locmem.LES.o getcor.o degcnt.LES.o decnvh.o fastwt.o parallel.PIMD.o shake.o ene.PIMD.o mdwrit.o minrit.o set.o mdfil.o nmlsrc.o ew_box.o ew_bspline.o ew_fft.o ew_recip.LES.o pcshift.o align.o stack.o rfree.o rgroup.o random.o amopen.o debug.o ew_recip_reg.o ew_handle_dips.o ew_dipole_recip.o mexit.o new_time.o extra_pts.LES.o thermo_int.o matinv.o assert.o mmtsb.o mmtsb_client.o erfcfun.o veclib.o constantph.o prn_dipoles.o ips.o sglds.o qm_zero_charges.o qm_print_info.o qm_assign_atom_types.o qm_gb.o qm_ewald.o qm_extract_coords.o qm2_allocate_e_repul.o qm2_calc_charges.o qm2_calc_rij_and_eqns.o qm2_dihed.o qm2_energy.o qm2_fock.o qm2_get_qm_forces.o qm2_get_qmmm_forces.o qm2_h1elec.o qm2_hcore_qmqm.o qm2_hcore_qmmm.o qm2_identify_peptide_links.o qm2_load_params_and_allocate.o qm2_repp.o qm2_rotate_qmqm.o qm2_scf.o qm2_setup_orb_exp.o qm2_smallest_number.o qm2_dftb_module.o qm2_dftb_broyden.o qm2_dftb_dispersion_egr.o qm2_dftb_dispersion_params.o qm2_dftb_dispersionread.o qm2_dftb_eglcao.o qm2_dftb_energy.o qm2_dftb_ewevge.o qm2_dftb_externalchgrad.o qm2_dftb_externalshift.o qm2_dftb_fermi.o qm2_dftb_forces.o qm2_dftb_gamma.o qm2_dftb_gammamat.o qm2_dftb_get_qmmm_forces.o qm2_dftb_gettab.o qm2_dftb_load_params.o qm2_dftb_long_range.o qm2_dftb_main.o qm2_dftb_my_gradient.o qm2_dftb_my_mulliken.o qm2_dftb_repulsiv.o qm2_dftb_self.o qm2_dftb_shift.o qm2_dftb_short_range.o qm2_dftb_skpar.o qm2_dftb_slkode.o qm2_dftb_slktrafo.o is_init.o amoeba_valence.o amoeba_multipoles.o amoeba_recip.o amoeba_interface.o amoeba_direct.o amoeba_mdin.o amoeba_adjust.o amoeba_self.o amoeba_vdw.o amoeba_induced.o amoeba_runmd.o bintraj.o spatial_recip.o spatial_fft.o evb_vars.o evb_input.o evb_init.o evb_alloc.o evb_dealloc.o check_input.o evb_io.o evb_keywrd.o exchange_CM.o evb_mcp.o evb_force.o diabatic.o evb_2stdebug.o egap_umb_2stdebug.o exchange_gauss.o exchange_warshel.o morsify.o morse_anal2num.o evb_matrix.PIMD.o evb_ntrfc.PIMD.o evb_pimd_init.PIMD.o out_evb.PIMD.o \ ../lmod/lmod.a ../lapack/lapack.a ../blas/blas.a \ ../lib/nxtsec.o ../lib/sys.a -Wl,-framework -Wl,Accelerate /bin/mv sander sander.LES ambmask sander.PIMD ../../exe cd ptraj; make install xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o main.o main.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o rdparm.o rdparm.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o dispatch.o dispatch.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o help.o help.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o utility.o utility.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o second.o second.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o io.o io.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o trajectory.o trajectory.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o evec.o evec.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o torsion.o torsion.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o mask.o mask.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o rms.o rms.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o display.o display.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o interface.o interface.c xlc: 1501-216 command option -0 is not recognized - passed to ld 102 1500-010: (W) WARNING in interface: Infinite loop. Program may not stop. xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o energy.o energy.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o experimental.o experimental.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o ptraj.o ptraj.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o actions.o actions.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o analyze.o analyze.c xlc: 1501-216 command option -0 is not recognized - passed to ld /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND -DLES ../nmode/thermo.f > _thermo.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -c -qfree=f90 -o thermo.o _thermo.f ** thermo === End of Compilation 1 === ** symnum === End of Compilation 2 === ** mofi === End of Compilation 3 === 1501-510 Compilation successful for file _thermo.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ../sander/pubfft.f > _pubfft.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -qfree=f90 -qfree=f90 -o pubfft.o _pubfft.f ** cfftb === End of Compilation 1 === ** cfftb1 === End of Compilation 2 === ** cfftf === End of Compilation 3 === ** cfftf1 === End of Compilation 4 === ** cffti === End of Compilation 5 === ** cffti1 === End of Compilation 6 === ** passb === End of Compilation 7 === ** passb2 === End of Compilation 8 === ** passb3 === End of Compilation 9 === ** passb4 === End of Compilation 10 === ** passb5 === End of Compilation 11 === ** passf === End of Compilation 12 === ** passf2 === End of Compilation 13 === ** passf3 === End of Compilation 14 === ** passf4 === End of Compilation 15 === ** passf5 === End of Compilation 16 === ** pubz3d === End of Compilation 17 === ** pubz3di === End of Compilation 18 === "_pubfft.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_pubfft.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. "_pubfft.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _pubfft.f. cd ../lapack; make Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' ar rvs lapack.a xerbla.o r - xerbla.o ranlib lapack.a cd ../arpack; make Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ivout.f > _ivout.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o ivout.o _ivout.f ** ivout === End of Compilation 1 === 1501-510 Compilation successful for file _ivout.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dvout.f > _dvout.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dvout.o _dvout.f ** dvout === End of Compilation 1 === 1501-510 Compilation successful for file _dvout.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dgetv0.f > _dgetv0.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dgetv0.o _dgetv0.f ** dgetv0 === End of Compilation 1 === 1501-510 Compilation successful for file _dgetv0.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dlaqrb.f > _dlaqrb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dlaqrb.o _dlaqrb.f ** dlaqrb === End of Compilation 1 === "_dlaqrb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dlaqrb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dnaitr.f > _dnaitr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dnaitr.o _dnaitr.f ** dnaitr === End of Compilation 1 === "_dnaitr.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dnaitr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dnapps.f > _dnapps.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dnapps.o _dnapps.f ** dnapps === End of Compilation 1 === "_dnapps.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dnapps.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dnaup2.f > _dnaup2.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dnaup2.o _dnaup2.f ** dnaup2 === End of Compilation 1 === "_dnaup2.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dnaup2.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dnaupd.f > _dnaupd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dnaupd.o _dnaupd.f ** dnaupd === End of Compilation 1 === "_dnaupd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dnaupd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dnconv.f > _dnconv.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dnconv.o _dnconv.f ** dnconv === End of Compilation 1 === "_dnconv.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dnconv.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dneigh.f > _dneigh.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dneigh.o _dneigh.f ** dneigh === End of Compilation 1 === "_dneigh.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dneigh.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dmout.f > _dmout.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dmout.o _dmout.f ** dmout === End of Compilation 1 === 1501-510 Compilation successful for file _dmout.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dneupd.f > _dneupd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dneupd.o _dneupd.f ** dneupd === End of Compilation 1 === "_dneupd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dneupd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dngets.f > _dngets.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dngets.o _dngets.f ** dngets === End of Compilation 1 === 1501-510 Compilation successful for file _dngets.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dsaitr.f > _dsaitr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dsaitr.o _dsaitr.f ** dsaitr === End of Compilation 1 === "_dsaitr.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dsaitr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dsapps.f > _dsapps.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dsapps.o _dsapps.f ** dsapps === End of Compilation 1 === "_dsapps.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dsapps.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dsaup2.f > _dsaup2.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dsaup2.o _dsaup2.f ** dsaup2 === End of Compilation 1 === "_dsaup2.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dsaup2.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dsaupd.f > _dsaupd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dsaupd.o _dsaupd.f ** dsaupd === End of Compilation 1 === "_dsaupd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dsaupd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dsconv.f > _dsconv.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dsconv.o _dsconv.f ** dsconv === End of Compilation 1 === "_dsconv.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dsconv.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dseigt.f > _dseigt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dseigt.o _dseigt.f ** dseigt === End of Compilation 1 === 1501-510 Compilation successful for file _dseigt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dsesrt.f > _dsesrt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dsesrt.o _dsesrt.f ** dsesrt === End of Compilation 1 === 1501-510 Compilation successful for file _dsesrt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dseupd.f > _dseupd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dseupd.o _dseupd.f ** dseupd === End of Compilation 1 === "_dseupd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dseupd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dsgets.f > _dsgets.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dsgets.o _dsgets.f ** dsgets === End of Compilation 1 === 1501-510 Compilation successful for file _dsgets.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dsortc.f > _dsortc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dsortc.o _dsortc.f ** dsortc === End of Compilation 1 === 1501-510 Compilation successful for file _dsortc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dsortr.f > _dsortr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dsortr.o _dsortr.f ** dsortr === End of Compilation 1 === 1501-510 Compilation successful for file _dsortr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dstatn.f > _dstatn.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dstatn.o _dstatn.f ** dstatn === End of Compilation 1 === 1501-510 Compilation successful for file _dstatn.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dstats.f > _dstats.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dstats.o _dstats.f ** dstats === End of Compilation 1 === 1501-510 Compilation successful for file _dstats.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND dstqrb.f > _dstqrb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o dstqrb.o _dstqrb.f ** dstqrb === End of Compilation 1 === "_dstqrb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _dstqrb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND svout.f > _svout.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o svout.o _svout.f ** svout === End of Compilation 1 === 1501-510 Compilation successful for file _svout.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sgetv0.f > _sgetv0.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o sgetv0.o _sgetv0.f ** sgetv0 === End of Compilation 1 === 1501-510 Compilation successful for file _sgetv0.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND slaqrb.f > _slaqrb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o slaqrb.o _slaqrb.f ** slaqrb === End of Compilation 1 === "_slaqrb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _slaqrb.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND snaitr.f > _snaitr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o snaitr.o _snaitr.f ** snaitr === End of Compilation 1 === "_snaitr.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _snaitr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND snapps.f > _snapps.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o snapps.o _snapps.f ** snapps === End of Compilation 1 === "_snapps.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _snapps.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND snaup2.f > _snaup2.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o snaup2.o _snaup2.f ** snaup2 === End of Compilation 1 === "_snaup2.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _snaup2.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND snaupd.f > _snaupd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o snaupd.o _snaupd.f ** snaupd === End of Compilation 1 === "_snaupd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _snaupd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND snconv.f > _snconv.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o snconv.o _snconv.f ** snconv === End of Compilation 1 === "_snconv.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _snconv.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sneigh.f > _sneigh.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o sneigh.o _sneigh.f ** sneigh === End of Compilation 1 === "_sneigh.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _sneigh.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND smout.f > _smout.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o smout.o _smout.f ** smout === End of Compilation 1 === 1501-510 Compilation successful for file _smout.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sneupd.f > _sneupd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o sneupd.o _sneupd.f ** sneupd === End of Compilation 1 === "_sneupd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _sneupd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sngets.f > _sngets.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o sngets.o _sngets.f ** sngets === End of Compilation 1 === 1501-510 Compilation successful for file _sngets.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ssaitr.f > _ssaitr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o ssaitr.o _ssaitr.f ** ssaitr === End of Compilation 1 === "_ssaitr.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ssaitr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ssapps.f > _ssapps.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o ssapps.o _ssapps.f ** ssapps === End of Compilation 1 === "_ssapps.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ssapps.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ssaup2.f > _ssaup2.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o ssaup2.o _ssaup2.f ** ssaup2 === End of Compilation 1 === "_ssaup2.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ssaup2.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ssaupd.f > _ssaupd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o ssaupd.o _ssaupd.f ** ssaupd === End of Compilation 1 === "_ssaupd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ssaupd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ssconv.f > _ssconv.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o ssconv.o _ssconv.f ** ssconv === End of Compilation 1 === "_ssconv.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _ssconv.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sseigt.f > _sseigt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o sseigt.o _sseigt.f ** sseigt === End of Compilation 1 === 1501-510 Compilation successful for file _sseigt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ssesrt.f > _ssesrt.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o ssesrt.o _ssesrt.f ** ssesrt === End of Compilation 1 === 1501-510 Compilation successful for file _ssesrt.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sseupd.f > _sseupd.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o sseupd.o _sseupd.f ** sseupd === End of Compilation 1 === "_sseupd.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _sseupd.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ssgets.f > _ssgets.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o ssgets.o _ssgets.f ** ssgets === End of Compilation 1 === 1501-510 Compilation successful for file _ssgets.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ssortc.f > _ssortc.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o ssortc.o _ssortc.f ** ssortc === End of Compilation 1 === 1501-510 Compilation successful for file _ssortc.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND ssortr.f > _ssortr.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o ssortr.o _ssortr.f ** ssortr === End of Compilation 1 === 1501-510 Compilation successful for file _ssortr.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sstatn.f > _sstatn.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o sstatn.o _sstatn.f ** sstatn === End of Compilation 1 === 1501-510 Compilation successful for file _sstatn.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sstats.f > _sstats.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o sstats.o _sstats.f ** sstats === End of Compilation 1 === 1501-510 Compilation successful for file _sstats.f. /opt/ibmcmp/xlf/8.1/exe/cpp -P -DNMLEQ -DCLINK_PLAIN -DXLF90 -DHASSECOND sstqrb.f > _sstqrb.f xlf90 -c -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfloat=nomaf -qfixed -O3 -qmaxmem=-1 -qarch=auto -qtune=auto -c -o sstqrb.o _sstqrb.f ** sstqrb === End of Compilation 1 === "_sstqrb.f", 1500-036 (I) The NOSTRICT option (default at OPT(3)) has the potential to alter the semantics of a program. Please refer to documentation on the STRICT/NOSTRICT option for more information. 1501-510 Compilation successful for file _sstqrb.f. ar rvs arpack.a ivout.o dvout.o dgetv0.o dlaqrb.o dnaitr.o dnapps.o dnaup2.o dnaupd.o dnconv.o dneigh.o dmout.o dneupd.o dngets.o dsaitr.o dsapps.o dsaup2.o dsaupd.o dsconv.o dseigt.o dsesrt.o dseupd.o dsgets.o dsortc.o dsortr.o dstatn.o dstats.o dstqrb.o svout.o sgetv0.o slaqrb.o snaitr.o snapps.o snaup2.o snaupd.o snconv.o sneigh.o smout.o sneupd.o sngets.o ssaitr.o ssapps.o ssaup2.o ssaupd.o ssconv.o sseigt.o ssesrt.o sseupd.o ssgets.o ssortc.o ssortr.o sstatn.o sstats.o sstqrb.o ar: creating archive arpack.a a - ivout.o a - dvout.o a - dgetv0.o a - dlaqrb.o a - dnaitr.o a - dnapps.o a - dnaup2.o a - dnaupd.o a - dnconv.o a - dneigh.o a - dmout.o a - dneupd.o a - dngets.o a - dsaitr.o a - dsapps.o a - dsaup2.o a - dsaupd.o a - dsconv.o a - dseigt.o a - dsesrt.o a - dseupd.o a - dsgets.o a - dsortc.o a - dsortr.o a - dstatn.o a - dstats.o a - dstqrb.o a - svout.o a - sgetv0.o a - slaqrb.o a - snaitr.o a - snapps.o a - snaup2.o a - snaupd.o a - snconv.o a - sneigh.o a - smout.o a - sneupd.o a - sngets.o a - ssaitr.o a - ssapps.o a - ssaup2.o a - ssaupd.o a - ssconv.o a - sseigt.o a - ssesrt.o a - sseupd.o a - ssgets.o a - ssortc.o a - ssortr.o a - sstatn.o a - sstats.o a - sstqrb.o ranlib arpack.a cd ../blas; make Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' ar rvs blas.a dummy.o r - dummy.o ranlib blas.a cd ../lib ; make sys.a make[2]: `sys.a' is up to date. cd pdb; make xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o pdbrun.o pdbrun.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o pdb_read.o pdb_read.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o pdb_sprntf.o pdb_sprntf.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o pdb_sscanf.o pdb_sscanf.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o pdb_write.o pdb_write.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o ms.o ms.c xlc: 1501-216 command option -0 is not recognized - passed to ld ar rvs libpdb.a pdbrun.o pdb_read.o pdb_sprntf.o pdb_sscanf.o pdb_write.o ms.o ar: creating archive libpdb.a a - pdbrun.o a - pdb_read.o a - pdb_sprntf.o a - pdb_sscanf.o a - pdb_write.o a - ms.o ranlib libpdb.a xlf90 -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfree=f90 -o rdparm main.o rdparm.o dispatch.o help.o utility.o second.o io.o trajectory.o evec.o torsion.o mask.o rms.o display.o interface.o energy.o experimental.o ptraj.o actions.o analyze.o thermo.o pubfft.o pdb/libpdb.a ../arpack/arpack.a ../lapack/lapack.a ../blas/blas.a ../lib/sys.a -Wl,-framework -Wl,Accelerate /usr/bin/ld: warning multiple definitions of symbol _second second.o definition of _second in section (__TEXT,__text) /System/Library/Frameworks/Accelerate.framework/Versions/A/Frameworks/vecLib.framework/Versions/A/libLAPACK.dylib(single module) definition of _second xlf90 -qextname=ddot:fdate:flush:lsame:dscal:dnrm2:idamax:drot:dswap:dspmv:daxpy:dspr2:dgemm:dcopy:dgemv:dtrmv:dtrmm:dger:lsame:dspev:dgeev:dspevd:dsyev:dppsv:dspsv:dlamch:dsteqr:dgeqr2:dorm2r:dlacpy:dlarnv:dlascl:dlaset:dlartg:dlanst:dlaev2:dlapy2:dlasr -qfree=f90 -o ptraj main.o rdparm.o dispatch.o help.o utility.o second.o io.o trajectory.o evec.o torsion.o mask.o rms.o display.o interface.o energy.o experimental.o ptraj.o actions.o analyze.o thermo.o pubfft.o pdb/libpdb.a ../arpack/arpack.a ../lapack/lapack.a ../blas/blas.a ../lib/sys.a -Wl,-framework -Wl,Accelerate /usr/bin/ld: warning multiple definitions of symbol _second second.o definition of _second in section (__TEXT,__text) /System/Library/Frameworks/Accelerate.framework/Versions/A/Frameworks/vecLib.framework/Versions/A/libLAPACK.dylib(single module) definition of _second /bin/mv rdparm ptraj ../../exe cd nmr_aux; make install cd prepare_input; make clean ; make install /bin/rm *.o _*.f makeDIST_RST makeANG_RST makeSHF.cp makeCHIR_RST.cp \ makeDIP_RST.protein.cp makeDIP_RST.dna.cp rm: *.o: No such file or directory rm: _*.f: No such file or directory rm: makeDIST_RST: No such file or directory rm: makeANG_RST: No such file or directory rm: makeSHF.cp: No such file or directory rm: makeCHIR_RST.cp: No such file or directory rm: makeDIP_RST.protein.cp: No such file or directory rm: makeDIP_RST.dna.cp: No such file or directory make[2]: [clean] Error 1 (ignored) xlc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O0 -Ddspev=dspev_ -DCLINK_PLAIN -I/usr/include/malloc -o makeDIST_RST.o makeDIST_RST.c xlc: 1501-216 command option -0 is not recognized - passed to ld xlc -o makeDIST_RST makeDIST_RST.o -lm /usr/bin/ld: can't open: NULL (No such file or directory, errno = 2) make[2]: *** [makeDIST_RST] Error 1 make[1]: *** [install] Error 2 make: *** [serial] Error 2