[gmx-users] multiple torsions for one dihedral

Amin Arabbagheri amin_arab at yahoo.com
Tue Nov 2 07:05:57 CET 2010

Hi all,

I'm using AMBER99p force field in GROMACS. In the AMBER forcefield for some dihedrals, there are several values, in which n values are different.  
As an example, for C3-C3-N-C, I have
C3-C3-N-C   .50  180.0  -4
C3-C3-N-C   .15  180.0  -3
C3-C3-N-C   .53      0.0   1

For the version 4, is there a convenient way to use these multiple 

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