Lipkowitz / Boyd Reviews in Computational Chemistry / Reviews in Computational Chemistry, Volume 16

1. Auflage 2009
ISBN: 978-0-470-12621-9
Verlag: John Wiley & Sons
Format: PDF
Kopierschutz: 0 - No protection

E-Book, Englisch, Band 16, 368 Seiten, E-Book

Reihe: Reviews in Computational Chemistry

Volume 16
Reviews In Computational Chemistry
Kenny B. Lipkowitz and Donald B. Boyd
The focus of this book is on methods useful in molecular design.Tutorials and reviews span (1) methods for designing compoundlibraries for combinatorial chemistry and high throughputscreening, (2) the workings of artificial neural networks and theiruse in chemistry, (3) force field methods for modeling materialsand designing new substances, and (4) free energy perturbationmethods of practical usefulness in ligand design.
From Reviews of the Series
"This series spans all the subdisciplines in the field, fromtechniques to practical applications, and includes reviews frommany of the acknowledged leaders in the field. the reviews crossmany subdisciplines yet are both general enough to be of wideinterest while including detailed information of use to workers inparticular subdisciplines." -Journal of the American ChemicalSociety

Autoren/Hrsg.

Lipkowitz, Kenny B.

Boyd, Donald B.

Inhaltsverzeichnis

Cumputer-Aided Molecular Diversity Analysis and CombinatorialLibrary Design (R. Lewis, et al.).
Artificial Neural Networks and Their Use in Chemistry (K.Peterson).
Use of Force Fields in Materials Modeling (J.-R. Hill, etal.).
Free Energy Calculations: Use and Limitations in Predicting LigandBinding Affinities (M. Reddy, et al.).
Indexes.