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Science/Engineering Mathematical Challenges from Theoretical/Computational Chemistry

Posted on 2010-03-15




Name:Science/Engineering Mathematical Challenges from Theoretical/Computational Chemistry
ASIN/ISBN:0309050979
Language:English
File size:2.33 Mb
File Type: PDF
Pages: 131 pages
Language: English language
ISBN: 0309050979
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Mathematical Challenges from Theoretical/Computational Chemistry Author: National Research Council Staff Publisher: National Academies Press

Computational methods are rapidly becoming major tools of theoretical, pharmaceutical, materials, and biological chemists. Accordingly, the mathematical models and numerical analysis that underlie these methods have an increasingly important and direct role to play in the progress of many areas of chemistry. This book explores the research interface between computational chemistry and the mathematical sciences. In language that is aimed at non-specialists, it documents some prominent examples of past successful cross-fertilizations between the fields and explores the mathematical research opportunities in a broad cross-section of chemical research frontiers. It also discusses cultural differences between the two fields and makes recommendations for overcoming those differences and generally promoting this interdisciplinary work.

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