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About this product
Product Identifiers
PublisherWiley & Sons, Incorporated, John
ISBN-100471847356
ISBN-139780471847359
eBay Product ID (ePID)1226996
Product Key Features
Number of Pages253 Pages
Publication NameComputer Software Applications in Chemistry
LanguageEnglish
SubjectChemistry / Clinical, Chemistry / Computational & Molecular Modeling
Publication Year1986
TypeTextbook
Subject AreaScience
AuthorPeter C. Jurs
FormatHardcover
Dimensions
Item Height1 in
Item Weight19 Oz
Item Length9.8 in
Item Width6.6 in
Additional Product Features
Edition Number1
Intended AudienceScholarly & Professional
LCCN86-011088
Dewey Edition19
IllustratedYes
Dewey Decimal542/.8
Table Of ContentError, Statistics, and the Floating-point Number System.NUMERICAL METHODS.Curve Fitting.Multiple Linear Regression Analysis.Numerical Integration.Numerical Solution of Differential Equations.Matrix Methods and Systems of Linear Equations.Random Numbers and Monte Carlo Simulation.Simplex Optimization.NONNUMERICAL METHODS.Chemical Structure Information Handling.Mathematical Graph Theory.Substructure Searching.Molecular Mechanics.Pattern Recognition.Artificial Intelligence and Expert Systems.Spectroscopic Library Searching and Structure Elucidation.GRAPHICS.Graphical Display of Data.Graphical Display of Molecules.Index.
SynopsisThis book on computer software applications in chemistry goes beyond hardware interfacing and computer lab use. It is organized by topic - general aspects of computers, solution of equations by numerical means, abstract (non-numerical) chemical-structure information handling and molecular mechanics, and graphical displays of data and molecular structures. Each topic is supplemented frequently by FORTRAN programs which illustrate the ways in which computer software is applicable to the chemical field., This unique presentation of computer software applications in chemistry goes beyond hardware interfacing and computer lab use. The book is organized by topic: general aspects of computers, solution of equations by numerical means, abstract (nonnumerical) chemical-structure information handling and molecular mechanics, and graphical displays of data and molecular structures. Each topic is supplemented frequently by FORTRAN programs which illustrate the ways in which computer software is applicable to the chemical field.
LC Classification NumberQD39.3.E46J873 1987
