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Computational Modeling for Homogeneous and Enzymatic Catalysis

A Knowledge Base for Designing Efficient Catalysts

Morokuma, Keiji.
Keiji Morokuma, Djamaladdin G. Musaev

ISBN: 9783527318438
Format: Hardback
Publisher: John Wiley and Sons Ltd

Here, the world's most active and productive computational scientists from academia and industry present established, effective and powerful tools for understanding catalysts. With its broad scope - nitrogen fixation, polymerization, C-H bond activation, oxidations, biocatalysis and much more - this book represents an extensive knowledge base for designing efficient catalysts, allowing readers to improve the performance of their own catalysts.

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"...this book represents a substantial contribution and will be an important source of information for all researchers with an interest in catalysis." (Journal of the American Chemical Association, August 6, 2008)

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Here, the world's most active and productive computational scientists from academia and industry present established, effective and powerful tools for understanding catalysts. With its broad scope nitrogen fixation, polymerization, C H bond activation, oxidations, biocatalysis and much more, this book represents an extensive knowledge base for designing efficient catalysts, allowing readers to improve the performance of their own catalysts.

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