Dear users,
When I am using GROMACS 4.0.7 on the Compute node ，executing command:
mpiexec -n 4 mdrun_mpi -deffnm SWNT66nvt >/dev/null &
and then met a problem :mdrun_mpi: error while loading shared libraries:
libimf.so: cannot open shared object file: No such file or directory
but I have added export LD_LIBRARY_PATH=/opt/intel/fc/10.1.008/lib
in the .bash_profile, the libimf.so is in this directory.
However,when executing command:mdrun -deffnm SWNT66nvt &，it's OK ! Anybody
could help me? Thanks a lot!
Zhongjin He
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