[gmx-users] (no subject)

limingru mruli at sina.com
Tue Oct 24 15:30:15 CEST 2017

Dear all,              I want to use GMX to simulate ethanol solution interaction with macromolecular in a polarizable force filed. Whether the macromolecular and ethanol PDB files need adding Drude particles? and how to produce an ethanol.itp file for Drude2013 force field? Do the Drude2013 force field can be ran in the GMX v4.6.5? Thanks in advance.		Best wishes!

School of Nuclear Sci and Tec,
Beijing Normal University

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