[gmx-users] How to launch mdrun_mpi using g_tune_pme on a cluster

[Justin Lemkul]

On 11/12/12 7:40 AM, Venkat Reddy wrote:
> Dear Gromacs users,
>
> How to launch mdrun_mpi using g_tune_pme on a cluster, because
> *
> *
> *g_tune_pme -launch *launches mdrun but not mdrun_mpi.
>
> Thanks for your valuable time
>

Please read g_tune_pme -h, which describes how you can set the names of mpirun 
and mdrun executables.

-Justin

-- 
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Justin A. Lemkul, Ph.D.
Research Scientist
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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