[gmx-users] proper dihedrals

[Anton Feenstra]

Milton Taidi Sonoda wrote:
> Is there a way to model a proper dihedral
> as a sum of two or more terms of the expression
> 4.52 of the gromacs user manual using the
> [ dihedraltype ] section?

Yes, simply add as many as you want for a given set of atoms.
This will work for .itp/.top files, but may not work in .rtp files
for all versions.


-- 
Groetjes,

Anton
  _____________ _______________________________________________________
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|  _   _  ___,| K. Anton Feenstra                                     |
| / \ / \'| | | Dept. of Pharmacochem. - Vrije Universiteit Amsterdam |
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