[gmx-users] what's the parameters for angle restraints in mdp file

Chunxia Gao chunxia.gao at chem.gu.se
Wed Nov 30 21:38:54 CET 2011


Dear gmx users:

Do anybody know what is the parameters for angle restraints in mdp file, like distance restraint it will have like disre = simple and dihedral restraints will have dihre = yes, and what about for angle restraints? nothing? just defined the force constant and that atom index in topology file will be ok?

Thanks for answering back in advance.

Regards
Chunxia



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