9780841235908-0841235902-Combined Quantum Mechanical and Molecular Mechanical Methods (ACS Symposium Series)

Combined Quantum Mechanical and Molecular Mechanical Methods (ACS Symposium Series)

ISBN-13: 9780841235908
ISBN-10: 0841235902
Edition: 1
Author: Jiali Gao, Mark A. Thompson
Publication date: 1999
Publisher: American Chemical Society
Format: Hardcover 320 pages
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Book details

ISBN-13: 9780841235908
ISBN-10: 0841235902
Edition: 1
Author: Jiali Gao, Mark A. Thompson
Publication date: 1999
Publisher: American Chemical Society
Format: Hardcover 320 pages

Summary

Combined Quantum Mechanical and Molecular Mechanical Methods (ACS Symposium Series) (ISBN-13: 9780841235908 and ISBN-10: 0841235902), written by authors Jiali Gao, Mark A. Thompson, was published by American Chemical Society in 1999. With an overall rating of 4.0 stars, it's a notable title among other books. You can easily purchase or rent Combined Quantum Mechanical and Molecular Mechanical Methods (ACS Symposium Series) (Hardcover) from BooksRun, along with many other new and used books and textbooks. And, if you're looking to sell your copy, our current buyback offer is $0.34.

Description

Combined quantum mechanical and molecular mechanical methods (QM/MM) are one of the most promising approaches for quantum mechanical calculations of chemical processes in solution and in enzymes. In such a method a relatively small part of the system (e.g., the solute) is analyzed through quantum mechanics and the remainder (e.g., the solvent) is represented through molecular mechanics, thus combining the accuracy of one method with the efficiency of the other. This book provides an in-depth survey of the methods and their applications in chemistry and biochemistry.

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