[gmx-users] Does Gromacs support MVAPICH2 & MVAPICH2-GDR?

Mark Abraham mark.j.abraham at gmail.com
Wed Aug 31 16:40:36 CEST 2016


Hi,

Yes.
http://manual.gromacs.org/documentation/2016/install-guide/index.html#mpi-support

Mark

On Wed, Aug 31, 2016 at 4:12 PM DeChang Li <li.dc06 at gmail.com> wrote:

> Dear all,
>
> I want to use gromacs with MPI in Infiniband network & GPU. It seems that
> MVAPICH2 performs better with Infiniband network. Does gromacs support
> MVAPICH2?
>
> Best,
> Dechang Li, Ph.D
> =========================================
> *Biomechanics and Biomaterials Laboratory*
> *Department of Applied Mechanics*
> *School of Aerospace Engineering*
> *Beijing Institute of Technology*
> *Beijing 100081, P. R. China*
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