VMD-L Mailing List
From: elena ermakova (ermak090_at_mail.ru)
Date: Tue Dec 08 2015 - 02:48:04 CST
I would really appreciate if anyone can provide some input to the following question:
VMD is able to calculate interaction energy between any pair of residues along the trajectory.
Is any script which allow to calculate the interaction energies between ALL pairs of residues ( may be in cycle) and save them to file or files?
Thank you very much.