An Introduction to Chemoinformatics
Andrew R. Leach, V.J. GilletThis book aims to provide an introduction to the major techniques of chemoinformatics. It is the first text written specifically for this field. 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.
Κατηγορίες:
Έτος:
2003
Έκδοση:
2003
Εκδότης:
Springer
Γλώσσα:
english
Σελίδες:
255
ISBN 10:
1402013477
ISBN 13:
9781402013478
Αρχείο:
PDF, 5.70 MB
IPFS:
,
english, 2003