Download e-book for kindle: An Introduction to Chemoinformatics by Andrew R. Leach,V.J. Gillet

By Andrew R. Leach,V.J. Gillet

ISBN-10: 1402013477

ISBN-13: 9781402013478

ISBN-10: 1402062907

ISBN-13: 9781402062902

This publication goals to supply an creation to the main concepts of chemoinformatics. it's the first textual content written particularly for this box. the 1st a part of the e-book offers with the illustration of 2nd and 3D molecular buildings, the calculation of molecular descriptors and the development of mathematical types. the second one half describes different vital issues together with molecular similarity and variety, the research of enormous information units, digital screening, and library layout. basic illustrative examples are used all through to demonstrate key options, supplemented with case stories from the literature.

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An Introduction to Chemoinformatics by Andrew R. Leach,V.J. Gillet

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