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  • Open Daily: 10am - 10pm
    Alley-side Pickup: 10am - 7pm

    3038 Hennepin Ave Minneapolis, MN
    612-822-4611

Open Daily: 10am - 10pm | Alley-side Pickup: 10am - 7pm
3038 Hennepin Ave Minneapolis, MN
612-822-4611
An Introduction to Chemoinformatics

An Introduction to Chemoinformatics

Gillet, V. J.
Leach, Andrew R.

Hardcover

Medical ReferenceChemistryProgramming

ISBN10: 1402013477
ISBN13: 9781402013478
Publisher: Springer Nature
Published: May 31 2003
Pages: 255
Weight: 1.15
Height: 0.86 Width: 6.46 Depth: 9.50
Language: English

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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