Design and application of a molecular mechanics force field for alkyl iodides including an electrostatic polarization model
Author:
Publisher
Wiley
Subject
Computational Mathematics,General Chemistry
Reference52 articles.
1. Computational Chemistry, Wiley-Interscience, New York, 1985.
2. and Molecular Mechanics, Am. Chem. Soc. Monograph, Washington, D.C., 1982.
3. Polar bonds and polarizability in conformational energy calculations: Application of a polarization model to alkyl halides
4. Semiempirical calculation of conformational structure of 2,4-disubstituted pentanes
5. and J. Chem. Soc. B, 539 (1970).
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