[gmx-users] Number of hardware threads does not match OpenMP

Mark Abraham mark.j.abraham at gmail.com
Tue Apr 14 10:52:07 CEST 2015


On Tue, Apr 14, 2015 at 8:58 AM, Dries Van Rompaey <
dries.vanrompaey at gmail.com> wrote:

> Dear Szilárd,
>
> Thanks for your reply. I'll try your proposed fix.
> I was also wondering if the simulations performed could be affected in
> terms of reliability and accuracy or not (ie. do I need to redo the
> simulations already performed with the corrected settings)?
>

No, they're correct. Only efficiency is in question.

Mark


>
> Thanks!
>
> Dries
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