Dear Amber Users,
My system consists of a polymer molecule in explicit water(TIP3P) with
ions. Using MMGBSA I have to use a vacuum trajectory and topology files of
each ligand and receptor.
Now to calculate the binding free energy of solvent with the polymer
molecule how should I go about.
Thanks
Kirtana
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Received on Fri Apr 06 2012 - 11:00:04 PDT
