Książka Introduction to Chemoinformatics Andrew R. Leach

Introduction to Chemoinformatics

Język: Angielski
Oprawa: Twarda
Dostępność: Dostępna u dostawcy
Wysyłamy za 10-13 dni
496.99
Chemoinformatics draws upon techniques from many disciplines including computer science, mathematics...

Informacje o książce

Język
Angielski
Oprawa
Książka - Twarda
Data wydania
2003
strony
255
EAN
9781402013478
ISBN
1402013477
Enbook ID
01415256
Waga
550
Wymiary
166 x 242 x 22

Pełny opis

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.

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