Hi Joel,
Thank you very much.
On Wed, Jan 9, 2019 at 3:27 PM Joel Awuah wrote:
> Hi Shan,
> I am not quite sure if you want to generate an REMD simulation mobility in
> temperature space for the 30 replicas. If that be the case, then you can
> use the data in the replica_temperature.xvg file
Hi Shan,
I am not quite sure if you want to generate an REMD simulation mobility in
temperature space for the 30 replicas. If that be the case, then you can
use the data in the replica_temperature.xvg file to plot replica index vs
REMD steps. The 1st column in the file corresponds to the REMD
Dear Gromacs users,
How do we plot a graph for temperature vs swap step number using a REMD
simulation with 30 systems. I already generated the replica_temp.xvg and
replica_index.xvg files using demux.pl script.
Thank you.
Best Regards
Shan Jayasinghe
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