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Quantum Medicinal Chemistry

Quantum Medicinal Chemistry

Frank Alber, Paolo Carloni

Wiley-VCH
Collection: Methods & Principles in Medicinal Chemistry
Publication date : 2006-03-06

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Computational methods are transforming the work of chemical and pharmaceutical laboratories. Increasingly faster and more exact simulation algorithms have made quantum chemistry a valuable tool in the search for active substances.
Written by a team of leading international quantum chemists, this book is aimed at both beginners as well as experienced users of quantum chemical methods. All commonly used quantum chemical methods are treated here, including Density Functional Theory, quantum and molecular mechanical approaches. Numerous examples illustrate the use of these methods for dealing with problems in pharmaceutical practice, whether the study of inhibitor binding, identifying the surface load of active substances or deriving molecular descriptors using quantum chemical tools.
For anyone striving to stay ahead in this rapidly evolving field.

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About the book

Author

Frank Alber , Paolo Carloni

Imprint

Wiley-VCH

Collection

Methods & Principles in Medicinal Chemistry

Publication date

2006-03-06

Pages

294 pages

Print ISBN

9783527304561

Language

English

Ebook informations

EAN PDF

9783527605309

Price

£137.10

Copy count 0

Print count 294

File size 2744 Ko

Informations accessibility

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About author(s)

Frank Alber

Paolo Carloni

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