An introduction to chemoinformatics
by Andrew R. Leach and Valerie J. Gillet
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"This text aims to provide a comprehensive 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."--Jacket.
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Subjects
Cheminformatics, Chemistry, Programming - General, Chemistry - Physical & Theoretical, Science, Medical / Nursing, Science/Mathematics, Reference, Pharmacy, Computers-Programming - General, Medical / Pharmacy, Science / Chemistry / Physical & Theoretical, Science-Chemistry - Physical & Theoretical, Chemistry, data processing, Chemistry, mathematics, Computer-aided design, Combinatorial chemistry techniques--methods, Chemistry, pharmaceutical--methods, Drug design, Rs418 .l435 2003, 2004 h-020, Qv 744 l434i 2003, 615/.19/0285, Combinatorial Chemistry Techniques, Methods, Pharmaceutical Chemistry| Edition | Availability |
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1
An Introduction to Chemoinformatics
October 2007, Springer
Paperback
in English
- 1 edition
1402062907 9781402062902
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2
An Introduction to Chemoinformatics
May 1, 2003, Springer
Hardcover
in English
- 1 edition
1402013477 9781402013478
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3
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- Created November 16, 2008
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| May 28, 2025 | Edited by MARC Bot | import existing book |
| December 12, 2024 | Edited by MARC Bot | import existing book |
| December 20, 2023 | Edited by ImportBot | import existing book |
| January 7, 2023 | Edited by MARC Bot | import existing book |
| November 16, 2008 | Created by ImportBot | Imported from University of Toronto MARC record |