[gmx-users] Re: Atomtype OWT3 not found during EM step

juganta juganta280 at yahoo.com
Thu Jul 11 17:47:44 CEST 2013

Thanks Justin for your information. But I got those lines in /gromacs
4.5.5/top/tip3p.itp  --
#ifdef _FF_GROMACS
#include "gmx.ff/tip3p.itp"
#ifdef _FF_GROMOS96
#include "gromos43a1.ff/tip3p.itp"
#ifdef _FF_OPLS  
#include "oplsaa.ff/tip3p.itp"

I thought I can use tip3p.itp with G43a1 forcefield, becasue of the 2nd
Let me clear it.

Thanks in advance.

Juganta Roy

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