[gmx-users] MM-GB/SA analysis in Gromacs

kannan kannan.2910 at gmail.com
Fri Mar 7 08:21:24 CET 2014

Dear Andrea Spitaleri, 

I run protein-ligand complex for 20ns simulation in gromacs, i need to
calculate the binding free energy calculation. I had a look at
http://www.plosone.org/article/info%3Adoi%2F10.1371%2Fjournal.pone.0046902 ,
and i want  to calculate MM/PBSA binding free energy  using the tool you

So I kindly request you sir, to provide the valuable help sir...

My email id is: kannan.2910 at gmail.com

I am waiting for your reply.

Many thanks in advance
kannan s

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