[gmx-users] Re : Gromacs 4.0 parallelization

Itamar Kass itamar.kass at gmail.com
Sun Nov 8 01:05:37 CET 2009


Hi,

I think it is more important how you compiled you gromacs. Had you used
--enable-mpi?

Itamar

On Sun, Nov 8, 2009 at 2:08 AM, milad ekramnia <m.ekramnia at ph.iut.ac.ir>wrote:

> Hi Mark
> my mdrun command line  is :
> mpirun -n 4 mdrun_mpi -v -s topol.tpr
>
> regards
> --
> Milad Ekramnia
> Physics Department
> Isfahan University of Technology
> --
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