Reviews in Computational Chemistry
Volume 18
Reviews in Computational Chemistry (Series Nr. 18)
1. Edition November 2002
XXXIV, 350 Pages, Hardcover
Wiley & Sons Ltd
Short Description
Bringing together leading authorities in the field, this book provides necessary background and theory, strategies for implementing methods, pitfalls to avoid, applications, and references. The series contains updated and comprehensive compendiums of molecular modeling software that list hundred of programs, services, suppliers, and other practical information.
ISBN:
978-0-471-21576-9
John Wiley & Sons
* Provides detailed author and subject indices for quick reference.
* Presents chapters in non-mathematical terms for cross-expertise access.
Clustering Methods and Their Uses in Computational Chemistry (Geoff M. 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 in Computer Simulations (Steven W. Rick and Steven J. Stuart).
New Developments in the Theoretical Description of Charge-Transfer Reactions in Condensed Phases (Dmitry V. Matyushov and Gregory A. Voth).
Linear Free Energy Relationships Using Quantum Mechanical Descriptors (George R. Famini and Leland Y. Wilson).
The Development of Computational Chemistry in Germany (Sigrid D. Peyerimhoff).
Appendix. Examination of the Employment Environment for Computational Chemistry (Donald B. Boyd and Kenny B. Lipkowitz).
Author Index.
Subject Index.
The Use of Scoring Functions in Drug Discovery Applications (Hans-Joachim Böhm and Martin Stahl).
Potentials and Algorithms for Incorporating Polarizability in Computer Simulations (Steven W. Rick and Steven J. Stuart).
New Developments in the Theoretical Description of Charge-Transfer Reactions in Condensed Phases (Dmitry V. Matyushov and Gregory A. Voth).
Linear Free Energy Relationships Using Quantum Mechanical Descriptors (George R. Famini and Leland Y. Wilson).
The Development of Computational Chemistry in Germany (Sigrid D. Peyerimhoff).
Appendix. Examination of the Employment Environment for Computational Chemistry (Donald B. Boyd and Kenny B. Lipkowitz).
Author Index.
Subject Index.