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On Wed, Sep 11, 2019, 10:44 AM Jinfeng Huang <wwsshhjjff00.163.com> wrote:
> Dear Amber users,
>
>
> I recently tried to use Amber18 and 16 pmemd.cuda to run triplicated
> jobs, but I got exactly the same trajectory for all three trials(final
> coordinate file and output (energy, temperature, etc.) files are same )
> with a different random seed for Amber18 and also get several same
> trajectories by using Amber16. I'm not sure if there any problems with the
> random seed or the installation on the cluster is wrong.
>
>
> Any reply will be very grateful. Thank you!
>
>
> With regards,
> Jinfeng
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Received on Wed Sep 11 2019 - 08:30:05 PDT
