Evolutionary Algorithms in Molecular Design

作者: David E. Clark

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摘要: From the Publisher: "This book highlights versatility of evolutionary algorithms in areas relevance to molecular design with a particular focus on drug design. The authors, all whom are experts their field, discuss application these computational methods wide range research problems including conformational analysis, chemometrics and quantitative structure-activity relationships, de novo design, chemical structure handling, combinatorial library study protein folding. In addition, use determination structures by X-ray crystallography NMR spectroscopy is also covered." "These state-of-the-art reviews, together discussion new techniques future developments make this truly valuable highly up-to-date resource for anyone engaged or development computer-assisted scientific research."--BOOK JACKET.

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