[gmx-users] entropic contribution from Umbrella Sampling

Steven Neumann s.neumann08 at gmail.com
Sat Mar 17 21:28:17 CET 2012

Dear Gmx Users,

I am wondering whether is there any possibility to extract the entropic
part of the binding free energy of the ligand to protein using Umbrella

Thaank you,

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20120317/ed96a6d4/attachment.html>

More information about the gromacs.org_gmx-users mailing list