[gmx-users] angle restraints
Mark Abraham
mark.abraham at anu.edu.au
Thu Jun 10 11:51:34 CEST 2010
----- Original Message -----
From: subarna thakur <thakur.subarna at yahoo.co.in>
Date: Thursday, June 10, 2010 16:41
Subject: [gmx-users] angle restraints
To: gmx-users at gromacs.org
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> hello > I want to add angle restraints in my itp file for a ligand. what is the proper way of inserting angle restraint in .itp file ? Is there any keywords I have to add to my .mdp file for angle restraints? I have searched the mail archieve, I found many things about adding dihedral angle restraints but I couldnot find anything about adding angle restrains.
It's in the manual.
Mark
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