Hi
if your molecule is a ligand, you could use ParamChem
(https://cgenff.paramchem.org/)
Stéphane
----------------------------------------------------------------------
Message: 1
Date: Wed, 4 Oct 2017 10:10:24 +0200 (CEST)
From: Sergio Manzetti <sergio.manze...@fjordforsk.no>
To: gmx-users <gmx-us...@gromacs.org>
Subject: [gmx-users] Topolgen and topolbuild
Message-ID:
<1029199322.16738012.1507104624251.javamail.zim...@fjordforsk.no>
Content-Type: text/plain; charset=utf-8
Hi, I found these tow programs on GMX site, however they don't work. How can I
generate a CHARMM topology to be used in GMX for a charged molecule?
Sergio Manzetti
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