[gmx-users] constraint distance between ligand and protein

kanin wichapong kwichapong at gmail.com
Mon Sep 11 17:36:32 CEST 2006


Hi All,
    I would like to know how to make a distance constraint between the
ligand and the protein. If I just merge two chain together by pdb2gmx, it
can done if the two chain are both protein. However, if it is a ligand and
protein, i can't merge together because there is no libraly for the ligand
force field and then it can't generate the .itp or .top file

Best Regard
Kanin
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