I have been trying to compile amber10 with ifort 101 unsuccessfully.
AmberTools did compile quite smooth but amber10 stops with the
message
cpp -traditional -P -DBINTRAJ nmr.f > _nmr.f
ifort -c -w95 -vec_report0 -mp1 -ip -O3 -axNP -FR -o nmr.o _nmr.f
_nmr.f(1240): (col. 12) remark: nmr_mp_getnat_ has been targeted for
automatic cpu dispatch.
_nmr.f(8786): (col. 12) remark: nmr_mp_r6drv_ has been targeted for
automatic cpu dispatch.
_nmr.f(3229): (col. 12) remark: nmr_mp_nmrcms_ has been targeted for
automatic cpu dispatch.
_nmr.f(289): (col. 12) remark: nmr_mp_at2res_ has been targeted for
automatic cpu dispatch.
_nmr.f(575): (col. 12) remark: nmr_mp_commass_ has been targeted for
automatic cpu dispatch.
_nmr.f(502): (col. 12) remark: nmr_mp_chklin_ has been targeted for
automatic cpu dispatch.
ifort: error #10106: Fatal error in /opt/intel/fc/10.1.018/bin/fortcom,
terminated by kill signal
compilation aborted for _nmr.f (code 1)
make[1]: *** [nmr.o] Error 1
make[1]: se sale del directorio
`/home/aldo/CLASSICAL_MD/Amber/amber10/src/sander'
make: *** [serial] Error 2
I am not sure if the problem is the compiler or there is something
missing during the configure procedure.
Any comments/help will be greatly appreciate it
regards
--
Prof. Aldo Humberto Romero
CINVESTAV-Unidad Queretaro
Libramiento Norponiente 2000
CP 76230, Queretaro, QRO, Mexico
tel: 442 211 9909
fax: 442 211 9938
email: aromero.qro.cinvestav.mx
aldorome.gmail.com
www: qro.cinvestav.mx/~aromero
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Received on Sun Jul 12 2009 - 18:08:49 PDT
