Molecular Modelling for Beginners

Molecular Modelling for Beginners

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Presenting a concise, basic introduction to modelling and computational chemistry this text includes relevant introductory material to ensure greater accessibility to the subject. Provides a comprehensive introduction to this evolving and developing field Focuses on MM, MC, and MD with an entire chapter devoted to QSAR and Discovery Chemistry. Includes many real chemical applications combined with worked problems and solutions provided in each chapter Ensures that up-to-date treatment of a variety of chemical modeling techniques are introduced.There are a number of classic (and hard) texts in the field; if Ia#39;m stuck with a basic molecular quantum mechanics problem, I usually reach for Eyring, Walter and ... I assume that you are a a#39;Beginnera#39; in the sense of Chambers Dictionarya€“a#39;someone who begins; ... In Chapter 8 I give a quick guide to statistical thermodynamics (if such a thing is possible), because we need to make use of the concepts whenanbsp;...

Title:Molecular Modelling for Beginners
Author: Alan Hinchliffe
Publisher:John Wiley & Sons - 2005-12-17

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