Computer-assisted Structure Elucidation

Hardcover

ISBN 10: 0471898244 ISBN 13: 9780471898245

Publisher: John Wiley & Sons Inc, 1986

Drawing on a wide range of recent research, this book introduces the most important new algorithms for solving problems in structural chemistry. It is a review of problems related to the representation and manipulation of chemical data, illustrated with various approaches to their solutions. Computer-Assisted Structure Elucidation also introduces graph- theoretic and other essential algorithms. It supplies all of the background information necessary to follow the formal mathematical presentations in the material.