[gmx-users] remd
Mark Abraham
mark.j.abraham at gmail.com
Thu Nov 14 13:36:22 CET 2013
Yes, just tell your MPI setup to do that. Performance will degrade, and
mdrun will complain that it can't set processor affinities, which is fine
for your purpose.
Mark
On Nov 14, 2013 7:06 AM, "Shine A" <shine.a at iisertvm.ac.in> wrote:
> sir,
>
> I have a basic doubt about remd simulation. In remd is it possible to
> run 16 replicas in 8 processors?
> --
> gmx-users mailing list gmx-users at gromacs.org
> http://lists.gromacs.org/mailman/listinfo/gmx-users
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/Search before posting!
> * Please don't post (un)subscribe requests to the list. Use the
> www interface or send it to gmx-users-request at gromacs.org.
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
More information about the gromacs.org_gmx-users
mailing list