[gmx-users] Chemical Potential

Steven Neumann s.neumann08 at gmail.com
Thu Jan 19 11:34:39 CET 2012


  Does anyone can help?


Dear Gmx Users,

I am wondering whether it is possible to obtain in Gromacs chemical
potential e.g. of water in the protein - ligand system?
Please, advise me to do some further reading, suggest method, maybe
tutorial?

Thank you,

Steven
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