Contributors

D. Giammona, D. Case, C. Bayly

Reference

Giammona, DA
Ph.D. thesis, University of California, Davis (1984)

Comments

Force field modifcations for all-atom heme
N.B.: parameters around the iron atom are appropriate for a six-coordinate (ligand bound) hemoglobin/myoglobin.
Force field parameters were adapted from D.A. Giammona, Ph.D. thesis, University of California, Davis (1984). ---dac 12/90
I modified & added to dac's original set - C.Bayly 10/95

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Last modified Fri Jun 29 17:44:33 BST 2001