Hi
>From GROMOS
IMPROPER DIHEDRAL
#define gi_1 0.0 167.42309
planar group 40
TO AMBER
IMPROPER
ca-ca-ca-ne 40.05 180.0 2.0
167.42309kJ/mol=40.05 kcal/mol
Could anyone tell me if the two set of the force field parameters are the same?
Thanks
Lin
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Received on Wed May 07 2008 - 06:07:46 PDT
