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Lipkowitz, Kenneth B.

Reviews in Computational Chemistry

Lipkowitz, Kenneth B. - Reviews in Computational Chemistry, ebook

253,00€

Ebook, PDF with Adobe DRM
ISBN: 9780470126134
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Printing30 pages with an additional page accrued every day, capped at 30 pages
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A select group of scientists from around the world join in this volume to create unique chapters aimed at both the novice molecular modeler and the expert computational chemist. Chapter 1 shows how molecular modeling of peptidomimetics plays a key role in drug discovery. Specific examples of successful computer-aided drug design are spelled out. Chapter 2 is a definitive exposition on thermodynamic perturbation and thermodynamic integration approaches in molecular dynamics simulations. Three additional chapters elucidate molecular modeling of carbohydrates, the best empirical force fields to use in molecular mechanics, and molecular shape as a useful quantitative descriptor.

Author(s)
 
Publisher
John Wiley and Sons, Inc.
Publication year
1996
Language
en
Edition
1
Series
Reviews in Computational Chemistry
Category
Natural Sciences
Format
Ebook
eISBN (PDF)
9780470126134
Printed ISBN
9780471186397

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