[gmx-users] How to calculate the interaction energy between twomolecules
ric.concu at gmail.com
Fri Apr 15 10:51:16 CEST 2016
you should use the g_energy tool. Remember to include the .ndx file in your
Sent: Friday, April 15, 2016 10:23 AM
To: gromacs.org_gmx-users at maillist.sys.kth.se
Subject: [gmx-users] How to calculate the interaction energy between
I have a question to ask you to help
I have two molecules A and B in my simulation system, and they are very
I want to know how to calculate their interaction energy after energy
minimization in gromacs
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