[gmx-users] Interaction energy..
ramadavidgroup at gmail.com
Fri Oct 5 16:16:19 CEST 2012
Hi gromacs friends,
I completed the simulation of receptor and ligand,
I visualized the trajectory in the vmd I found most of the time C terminal
(ARG) interact with receptor ( 320 ASP) .
I want to find out these interaction energy between these two residues in
How to find these interaction energy????
( include the LJ and electrostatic interaction)..
Thank you in advance.
With best wishes and regards.
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