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Ab initio calculations and molecular mechanics (MM3) force field development for ammonium and protonated aliphatic amines.
Guyan Liang
Xiannong Chen
John A. Dustman
Anita H. Lewin
J. Phillip Bowen
Published in:
J. Comput. Chem. (1997)
Keyphrases
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force field
protein structure prediction
active contour model
b spline