An Introduction to Chemoinformatics - Softcover

Leach, Andrew R.

 
9781402062902: An Introduction to Chemoinformatics
Softcover
ISBN 10: 1402062907 ISBN 13: 9781402062902
Verlag: Springer Netherlands, 2007

Inhaltsangabe

Chemoinformatics draws upon techniques from many disciplines including computer science, mathematics, computational chemistry and data visualisation to tackle these problems.

This, the first text written specifically for this field, aims to provide an introduction to the major techniques of chemoinformatics. The first part of the book deals with the representation of 2D and 3D molecular structures, the calculation of molecular descriptors and the construction of mathematical models. The second part describes other important topics including molecular similarity and diversity, the analysis of large data sets, virtual screening, and library design. Simple illustrative examples are used throughout to illustrate key concepts, supplemented with case studies from the literature.

The book is aimed at graduate students, final-year undergraduates, and professional scientists. No prior knowledge is assumed other than a familiarity with chemistry and some basic mathematical concepts.

Die Inhaltsangabe kann sich auf eine andere Ausgabe dieses Titels beziehen.

Verlag
Springer Netherlands
Erscheinungsdatum
2007
Sprache
Englisch
ISBN 10 
1402062907
ISBN 13 
9781402062902
Einband
Taschenbuch
Anzahl der Seiten
272
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