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KNOWLEDGE FOR GENERATIONS

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Cover image for product 0471188107
Reviews in Computational Chemistry, Volume 2
ISBN: 978-0-471-18810-0
Hardcover
544 pages
August 1991
US $225.00 Add to Cart

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  • Description
  • Table of Contents
A Survey of Methods for Searching thr Conformational Space of Small and Medium-Sized Molecules (A. Leach).

Simplified Models for Understanding and Predicting Protein Structure (J. Troyer and F. Cohen).

Moleculaar Mechanics: The Art and Science of Parameterization (J. Bowen and N. Allinger).

New Approaches to Empirical Force Fields (U. Dinur and A. Hagler).

Calculating the Properties of Hydrogen Bonds by ab Initio Methods (S. Scheiner).

Net Atomic Charge and Multiple Models for the ab Initio Molecular Electric Potential (D. Williams).

Molecular Electrostatic Potentials and Chemical Reactivity (P. Politzer and J. Murray).

Semiempirical Molecular Orbital Methods (M. Zerner).

The Molecular Connectivity Chi Indexes and Kappa Shape Indexes in Structure-Property Modeling (L. Hall and L. Kier).

The Electron-Topological Approach to the QSAR Problem (I. Bersuker and A. Dimoglo).

The Computational Chemistry Literature (D. Boyd).

Appendix: Compendium of Software for Molecular Modeling (D. Boyd).

Author Index.

Subject Index.