Reviews in Computational Chemistry

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Published by Wiley-VCH .

Written in English

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Edition Notes

Book details

ContributionsKenneth B. Lipkowitz (Editor), Donald B. Boyd (Editor)
The Physical Object
Number of Pages504
ID Numbers
Open LibraryOL7613003M
ISBN 100471185965
ISBN 109780471185963

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Experts in computational chemistry, the editors use and develop techniques for computer-assisted molecular design. The core of the text itself deals with techniques for computer-assisted molecular design. The Reviews in Computational Chemistry series brings together leading authorities in the field to teach the newcomer and update the expert on topics centered around molecular modeling, such as computer-assisted molecular design (CAMD), quantum chemistry, molecular mechanics and dynamics, and quantitative structure-activity relationships (QSAR).

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Lipkowitz, Raima Larter, and Thomas R. Cundari This volume, like those prior to it, features chapters by experts in various fields of Reviews in Computational Chemistry book chemistry.

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The core of the book deals with techniques for computer-assisted molecular modelling and software for molecular recognition and the relationship between structure and biological activity of drug molecules is discussed. She has published scientific papers, reviews, books and book chapters in the area of Synthetic Organic Medicinal and Natural Products Chemistry.

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Lipkowitz Raima Larter Thomas R. Cundari. Computational Quantum Chemistry: Insights into Polymerization Reactions consolidates extensive research results, couples them with computational quantum chemistry (CQC) methods applicable to polymerization reactions, and presents those results systematically.

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Computational chemistry is a branch of chemistry that uses computer simulation to assist in solving chemical problems. It uses methods of theoretical chemistry, incorporated into efficient computer programs, to calculate the structures and properties of molecules and solids.

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chemistry problems has lagged behind that of the organic realm with respect to the quantity and quality of simulation tools. The gap between inorganic and organic applications has narrowed greatly, and the present volume highlights the state of the art in computational inorganic chemistry.

The editors of this book have amassed a veritable "who'sAuthor: Thomas R. Cundari.

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