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Designing Bioactive Molecules: Three-Dimensional Techniques and Applications (Computer Applications in Chemistry Collection)

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[PDF.hb52] Designing Bioactive Molecules: Three-Dimensional Techniques and Applications (Computer Applications in Chemistry Collection)

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 | #8852850 in Books |  1997-11-27 | Original language:English | PDF # 1 |  6.20 x.80 x8.90l,1.18 | File type: PDF | 352 pages

||About the Author|Yvonne Connolly Martin is at Abbott Laboratories. Peter Willett is in the Department of Information Studies at the University of Sheffield.

Three-dimensional structural information often provides the key to discovering or designing bioactive molecules and compounds. This volume covers the principal computational techniques for processing three-dimensional structures of small molecules and compounds. It describes database construction and searching, analysis of structure-activity relationships by pharmacophore mapping and QSAR, prediction of biological potency of small molecules and compounds by QSAR and by d...

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