[gmx-users] mdrun_mpi command

Yinghong xieyh at hkusua.hku.hk
Fri Jun 18 03:50:25 CEST 2004

Dear all:
I need to execute Gromacs with MPI version, for example, in common PC with 1 CPU, we use the following command to make MD running.
mdrun -v -s em -e em -o em -c after_em.
What is the corresponding command with "mdrun_mpi"? assuming I use 16 parallel CPUs.
Another question: can I use "mdrun -np 16 -v -s em...." to replace "mdrun_mpi", are both the same?
Thanks !

HongKong Univ.
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