Computer Software Applications in Chemistry

Language: English

Published by John Wiley and Sons Inc, US, 1996

0471105872 / 9780471105879

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Intended specifically for practicing professionals and advanced students in chemistry and biochemistry, this invaluable book covers the full range of the computer applications in these fields, including numerical, nonnumerical, and graphics applications. New material includes multiple linear regression using MREG, principal-components analysis, Monte Carlo integration, parameterization of the force field, and molecular modeling software. Major areas covered include: * Error, Statistics, and the Floating-Point Number System * Curve Fitting * Multiple Linear Regression Analysis * Numerical Integration * Numerical Solution of Differential Equations * Matrix Methods and Linear Equation Systems * Random Numbers and Monte Carlo Simulation * Simplex Optimization * Chemical Structure Information Handling * Mathematical Graph Theory * Substructure Searching * Molecular Mechanics and Molecular Dynamics * Pattern Recognition * Artificial Intelligence and Expert Systems * Spectroscopic Library Searching and Structure Elucidation * Graphical Display of Data and of Molecules Whatever your area of research, this comprehensive, lucidly written book offers an indispensable resource of computer applications that will facilitate your work.…

Seller Inventory # LU-9780471105879

Title
Computer Software Applications in Chemistry
Author
Peter C. Jurs
Publisher
John Wiley and Sons Inc, US
Publication year
1996
Condition
New
Binding
Hardback
Language
English
ISBN 10
0471105872
ISBN 13
9780471105879
Edition
2nd Edition
Item weight
652 grams

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