Sleap is printing only positive values for DIHEDRAL_FORCE_CONSTANT. In the Glycam force field, instead of phase shifts, we use positive and negative force constants.
Is that on purpose?
:-) Lachele
Dr. B. Lachele Foley
Complex Carbohydrate Research Center
The University of Georgia
Athens, GA USA
lfoley.uga.edu
http://glycam.ccrc.uga.edu
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Received on Wed Mar 09 2011 - 13:00:05 PST