[AMBER] frame wise MMPBSA energy difference

From: Hirdesh Kumar <hirdesh.iitd.gmail.com>
Date: Wed, 21 Sep 2016 11:15:07 +0200

Hi,
I used MMPBSA to calculate the binding free energy of my protein-protein
complexes. All went well and I got the difference in energy. However, I
would like to print the energies for each frame.

How can I do that?

Thanks,
Hirdesh
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Wed Sep 21 2016 - 02:30:02 PDT
Custom Search