[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>
wrote:
> 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
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
> * For (un)subscribe requests visit
> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> send a mail to gmx-users-request at gromacs.org.
>
--
Chandan Kumar Choudhury
National Chemical Laboratory, Pune
India
*"All work and no play makes Jack a dull boy...”*
More information about the gromacs.org_gmx-users
mailing list