Hi,
I ran MD simulation and got mdout files which have information about potential energies.
By mistake, I've removed all mdout files, and now want to get the total potential and dihedral energies.
Is there any way to calculate them from the trajectory files?
Thank you,
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Wed Jan 31 2018 - 08:30:03 PST