Read more
Zusatztext "Describes computational chemistry tools useful for molecular design and other research applications." (SciTech Book News! March 2001)"...continues the tradition of up-to-date and insightful reviews in all areas of computational chemistry." (Journal of the American Chemical Society! Vol. 123! No. 35! 2001) Informationen zum Autor Kenny B. Lipkowitz , PhD, is a retired Professor of Chemistry from North Dakota State University. Donald B. Boyd was apponted Research Professor of Chemistry at Indiana University - Purdue University Indianapolis in 1994. He has published over 100 refereed journal papers and book chapters. Klappentext Führende Spezialisten der Computerchemie erläutern Ihnen auch in diesem 16. Band der bewährten Reihe Methoden zur Berechnung von Moleküleigenschaften. Auf ein Übermaß an mathematischen Herleitungen wird dabei verzichtet - so können auch Studenten oder Forscher, die sich nicht ständig mit Computerchemie beschäftigen, die Verfahren verstehen. Themen dieses Bandes sind unter anderem der Entwurf kombinatorischer Molekülbibliotheken, die Anwendung neuronaler Netze in der Chemie, Kraftfelder zur Modellierung von Werkstoffen und Methoden zur Vorhersage der Bindungsaffinität von Liganden. (09/00) Zusammenfassung 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. Inhaltsverzeichnis Cumputer-Aided Molecular Diversity Analysis and Combinatorial Library 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, et al.). Free Energy Calculations: Use and Limitations in Predicting Ligand Binding Affinities (M. Reddy, et al.). Indexes.
List of contents
Cumputer-Aided Molecular Diversity Analysis and Combinatorial Library 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, et al.).
Free Energy Calculations: Use and Limitations in Predicting Ligand Binding Affinities (M. Reddy, et al.).
Indexes.
Report
"Describes computational chemistry tools useful for molecular design and other research applications." (SciTech Book News, March 2001)
"...it is absolutely impossible without help to follow all the fields, sub-fields...that have branched off [of computational chemistry]. We are certainly fortunate to have a continuing series like Reviews in Computational Chemistry to provide some help. Volume 16 continues that tradition." (Journal of Molecular Graphics Modelling, Vol. 19, No. 6, 2001)
"...continues the tradition of up-to-date and insightful reviews in all areas of computational chemistry." (Journal of the American Chemical Society, Vol. 123, No. 35, 2001)
