[gmx-users] No domain decomposition

Chandan Choudhury iitdckc at gmail.com
Mon Sep 28 14:50:08 CEST 2015

g_tune_pme would give some useful information.

On Mon, Sep 28, 2015 at 6:05 PM, soumadwip ghosh <soumadwipghosh at gmail.com>

> Hi Chandan,
>                  I tried it once using -nt option but it failed . I
> kept it 8 although I dont know how to change the number of nodes for
> mdrun correctly. How do I know the value of x if I want to run say
> mdun -deffnm mdfinal -nt x. It is worth mentioning here that for my
> NPT and NVT mdrun proceeded smoothly and I am being troubled only in
> the production run stage. i would appreciate any sort of help. One
> more question - from the crashed mdfinal.log file is it possible to
> have some information about domain decomposition or the approximate
> value of -nt x?
> Regrads,
> Soumadwip
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Chandan Kumar Choudhury
National Chemical Laboratory, Pune

*"All work and no play makes Jack a dull boy...”*

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