Hi all,
A query related to rerunning MD.
For eg: After 5ns run of MD I need to rerun from 3ns
and I take the structure closest to it from the
trajectory files. Taking this 3ns.gro as the starting
structure I redo all the steps for preparation. In
such a case, I am assuming that the velocity will be
taken into account and I need not generate velocity
again.
Am I right?
Regards,
Raghu
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