Merck molecular force field. II. MMFF94 van der Waals and electrostatic parameters for intermolecular. interactions

Thomas A. Halgren. Merck molecular force field. II. MMFF94 van der Waals and electrostatic parameters for intermolecular. interactions. Journal of Computational Chemistry, 17(5-6):520-552, 1996. [doi]

Abstract

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