Lipkowitz / Boyd Reviews in Computational Chemistry / Reviews in Computational Chemistry, Volume 18

1. Auflage 2003
ISBN: 978-0-471-46142-5
Verlag: John Wiley & Sons
Format: PDF
Kopierschutz: Adobe DRM (»Systemvoraussetzungen)

E-Book, Englisch, Band 18, 384 Seiten, E-Book

Reihe: Reviews in Computational Chemistry

This volume, like those prior to it, features chapters by experts in various fields of computational chemistry. Topics covered in Volume 18 include molecular modeling, computer-assisted molecular design (camd), quantum chemistry, molecular mechanics and dynamics, and quantitative structure-activity relationships (qsar).

Autoren/Hrsg.

Lipkowitz, Kenny B.

Boyd, Donald B.

Inhaltsverzeichnis

Clustering Methods and Their Uses in Computational Chemistry (GeoffM. Downs and John M. Barnard).
The Use of Scoring Functions in Drug Discovery Applications(Hans-Joachim Böhm and Martin Stahl).
Potentials and Algorithms for Incorporating Polarizability inComputer Simulations (Steven W. Rick and Steven J. Stuart).
New Developments in the Theoretical Description of Charge-TransferReactions in Condensed Phases (Dmitry V. Matyushov and Gregory A.Voth).
Linear Free Energy Relationships Using Quantum MechanicalDescriptors (George R. Famini and Leland Y. Wilson).
The Development of Computational Chemistry in Germany (Sigrid D.Peyerimhoff).
Appendix. Examination of the Employment Environment forComputational Chemistry (Donald B. Boyd and Kenny B.Lipkowitz).
Author Index.
Subject Index.