[AMBER] Splitting the interaction energy

From: Eliac Brown <eliacbrown.yahoo.com>
Date: Wed, 9 Mar 2011 06:26:58 -0800 (PST)

Dear AMBER
My inhibitor binds to a couple amino-acids in the active site, I want to split the binding energy of the inhibitor to each residue, what option do I have, is there a method implemented in AMBER?
Give me just a hint
Thanks in advance
Eliac


      

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Received on Wed Mar 09 2011 - 06:30:06 PST
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