minimise in restarting first equilibration step

From: Khoualdi Asma Feriel (
Date: Mon Apr 13 2020 - 09:37:29 CDT


since the first equilibration step was stopped on hitting wall time without finishing, I want to use restart files to resume it. Since it is the first step, should I keep the minimize option in namd configuration file?


Asma Feriel

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