UNIQUAC parameters determined by molecular mechanics
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy,General Chemical Engineering
Reference19 articles.
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2. CHARMM: A Program for Macromolecular Energy, Minimization, and Dynamics Calculations;Brooks;J. Comp. Chem.,1983
3. Molecular Mechanincs;Burkert,1982
4. Engelsen S.B. Fabricius J. Rasmussen Kj 1994a. The Consistent Force Field. 1. Methods and Strategies for Optimization of Empirical Potential Energy Functions Acta Chemica Scandinavica in press reg. no. A 2663.
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