prepare structure from a NAMD production
Just Got Here
11:19:12 PM PST - Tue, Jan 23rd 2018
I plan to let my system be optimized using NWChem's QM/MM optimization.
How does one generate topology and restart files for a QM/MM system that has undergone production in NAMD?
Thank you!
Clicked A Few Times
9:58:12 AM PST - Wed, Feb 13th 2019
Bump
Bump for interest
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