[gmx-users] Running a single job using 2 different GROMACS version

[Mark Abraham]

On Mar 20, 2014 10:44 AM, "MUSYOKA THOMMAS" <mutemibiochemistry at gmail.com>
wrote:
>
> Dear Users,
> I have prepared a simulation job through to NPT equilibration using
GROMACS
> version 4.5.5. Since the final md run is quite long, I submitted the final
> mdrun job to a cluster with Gromacs version 4.5.7 installed. Is this in
any
> way going to affect my results?

Maybe - we release versions with bugs fixed for a reason! ;-) See
http://www.gromacs.org/About_Gromacs/Release_Notes/Versions_4.5.x for
clues. You will have to assess whether things mentioned there might be
relevant for your situation. Ask a focussed question if you need to.

Mark

> Thanks
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