[gmx-users] MPI GPU job failed
pall.szilard at gmail.com
Thu Aug 11 16:13:16 CEST 2016
Using a non-MPI launch command won't be useful in starting an
MPI-enabled build, so that's not correct.
Additionally, please use _reply_ to answer emails to avoid breaking threads.
On Thu, Aug 11, 2016 at 6:50 AM, Nikhil Maroli <scinikhil at gmail.com> wrote:
> gmx mdrun -nt X -v -deffnm XXX -gpu_id XYZ
> What about this?
> Assign sufficient number of threads
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