From: Acharya, Atanu (aacharya42_at_gatech.edu)
Date: Fri Mar 11 2022 - 16:52:02 CST
Hello everyone,
I am running constant pH simulations using NAMD 2.13. Because of a relatively small walltime enforced by our supercomputer, I needed to restart the constant pH simulation from incomplete runs. However, NAMD is not writing the cphrst files needed to restart a run. I have also tried to change the cphRestartFreq without any luck.
This question was posted a few years ago. Is there a solution to it?
Thank you so much for looking into it.
Best,
Atanu
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