[gmx-users] Energy decomposition from FEP

Nikhil Maroli scinikhil at gmail.com
Wed Sep 20 19:51:32 CEST 2017

Dear all,

How to compute van der waals and electrostatic contribution to free energy
from fep simulation. I have used slow growth procedure using the
appropriate mdp files and followed fep tutorial.
Thanks in advance.

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