[gmx-users] No data on Pullf and Pullx files after restart

Mark Abraham mark.j.abraham at gmail.com
Wed Apr 5 08:18:38 CEST 2017


That sounds like something an older version of GROMACS might have done.
Which is it? Does it happen with a new one?


On Tue, 4 Apr 2017 11:11 Souparno Adhikary <souparnoa91 at gmail.com> wrote:

> Hello,
> I restarted my umbrella sampling simulations using the tpbconv command. I
> used the -vel option in the command. It ran successfully. After that, when
> I am running the new simulations, pullf and pullx files are created for
> each sample but no data gets written in them.
> I am absolutely clueless how to solve this. Can you please help?
> Thanks in advance.
> Best regards,
> Souparno
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