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Product Details 基本信息 ISBN-13 书号 9780198557401 Author 作者 Grant Guy H. Format 版本 平装-胶订 Pages Number 页数 98页 Publisher 出版社 Oxford University Press Publication Date 出版日期 1995-03-30 Shipping Weight 商品重量 211g Language 语种 英语 Book Contents 内容简介 An ideal introduction to this fast growing area, this Primer describes the many computational methods currently used by practising chemists. The authors describe the various techniques available, and how they can be applied to single molecules, to assemblies of molecules, and to molecules undergoing reaction. An introductory chapter outlines hardware and software options, as well as investigating some applications and developments. Subsequent chapters cover quantum mechanics, molecular mechanics, statistical mechanics, the modelling of biomolecules, and drug design.

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Grant Guy H. /1995-03-30 /Oxford University Press

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No /2021-01-25 /Springer Nature Switzerland AG