Dear Amber users and experts,
I want to install pmemd on AMBER10 but I got the following error while I'm
trying to compile it.
My OS: Redhat enterprise 5.2 32bit
MKL: 8.0.1
IFORT: 11.1
INTELMPI:4.0
My configure script:
./configure linux_p4 ifort intelmpi bintraj
make install
Then I got this massage:
.
.
.
.
.
ifort -c -auto -tpp7 -xW -ip -O3 charmm_gold.f90
ifort: command line remark #10148: option '-tp' not supported
ifort -o pmemd gbl_constants.o gbl_datatypes.o state_info.o file_io_dat.o
mdin_ctrl_dat.o mdin_ewald_dat.o mdin_debugf_dat.o prmtop_dat.o inpcrd_dat.o
dynamics_dat.o img.o parallel_dat.o parallel.o gb_parallel.o pme_direct.o
pme_recip_dat.o pme_slab_recip.o pme_blk_recip.o pme_slab_fft.o
pme_blk_fft.o pme_fft_dat.o fft1d.o bspline.o pme_force.o pbc.o
nb_pairlist.o nb_exclusions.o cit.o dynamics.o bonds.o angles.o dihedrals.o
extra_pnts_nb14.o runmd.o loadbal.o shake.o prfs.o mol_list.o runmin.o
constraints.o axis_optimize.o gb_ene.o veclib.o gb_force.o timers.o
pmemd_lib.o runfiles.o file_io.o bintraj.o pmemd_clib.o pmemd.o random.o
degcnt.o erfcfun.o nmr_calls.o nmr_lib.o get_cmdline.o master_setup.o
pme_alltasks_setup.o pme_setup.o ene_frc_splines.o gb_alltasks_setup.o
nextprmtop_section.o angles_ub.o dihedrals_imp.o cmap.o charmm.o
charmm_gold.o /home/mohamad/amber10/src/netcdf/lib/libnetcdf.a
/opt/intel/mkl/8.0.1/lib/32/libmkl_ia32.a -L/opt/intel/mkl/8.0.1/lib/32
-lguide -lpthread -L/usr/local/bin/lib64 -lmpi -lmpiif -limf -lsvml
-Wl,-rpath=/opt/intel/impi/4.0.0.017/ia32/lib:/opt/intel/Compiler/11.1/059/
ld: cannot find -lmpiif
make[1]: *** [pmemd] Error 1
make[1]: Leaving directory `/home/mohamad/amber10/src/pmemd/src'
make: *** [install] Error 2
Can anybody help with this error?
I also attached config.h file.
All the best,
M. Reza
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Received on Mon Oct 25 2010 - 02:30:05 PDT
