Using computers in chemistry and chemical education / edited by Theresa Julia Zielinski and Mary L. Swift.
Contributor(s): Zielinski, Theresa Julia | Swift, Mary L.
Material type: BookPublisher: Washington, D.C. : American Chemical Society, 1997Description: xiii, 385 p. : ill. ; 26 cm.ISBN: 0841234655.Subject(s): Chemistry -- Data processing | Chemistry -- Computer-assisted instructionDDC classification: 542.85Item type | Current library | Call number | Copy number | Status | Date due | Barcode | Item holds |
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General Lending | MTU Bishopstown Library Lending | 542.85 (Browse shelf(Opens below)) | 1 | Available | 00074282 |
Enhanced descriptions from Syndetics:
Based on how computers are used in research and industry, this timely volume provides a practical curriculum for using computers in training chemists and other professionals. It spans the full range of applications, from spreadsheets to specialized software for ab initio calculations. With contributions from experts in a variety of fields, the book will be invaluable for anyone developing a college-level course in chemistry.
Includes bibliographical references and index.
Part I A view of the codependence of chemistry and computers: Beyond lecture - a vision of the computer in the modern chemistry classroom / Theresa Julia Zielinski and Mary L. Swift -- The evolution of computers in chemistry / Peter Lykos -- Training the practicing chemist / Robert Megargle -- Industrial considerations-information technology and its effect on corporate culture / Nancy Woo -- Computing and communications in chemistry education / Martin S. Ewing -- Part II Accessing chemical information: Information retrieval in chemistry across the internet / F. S. Varveri -- Coping with the transformation of chemical information / Carol Carr and Arleen N. Somerville -- Part III Fundamental computer skills in modern chemical practice: Beyond the basics: what chemistry students need to know about computing / Peter C. Jurs -- Spreadsheets for doing and teaching chemistry / Daniel E. Atkinson -- Software for teaching and using numerical methods in physical chemistry / Sidney H. Young, Jeffry D. Madura and Frank Rioux -- A framework for the teaching of computer-instrument interfacing / Kenneth L. Ratzlaff -- Statistical methods in chemistry: what and how they should be integrated into the curriculum / Karen D. Rappaport -- Visualization for chemists / John P. Ranck -- Part IV Computational chemistry in the curriculum: Ab initio techniques in chemistry: interpretation and visualization / James B. Foresman -- Computer chemistry: A curse or the way of the future? / Warren Hehre -- Molecular graphics and simulation of proteins and nucleic acids / Scott H. Northrup -- Molecular modeling and drug design / Alexander Tropsha and J. Philip Bowen -- Part V Teaching chemistry with computers: Teaching organic chemistry on-line-the promise and the reality / Carolyn Sweeney Judd and Robert G. Ford -- Computer-assisted instruction in chemistry / Stephen K. Lower.
Table of contents provided by Syndetics
- Part 1 A view of the codependence of chemistry and computers
- 1 Beyond lecture--a vision of the computer in the modern chemistry classroom
- 2 The evolution of computers in chemistry
- 3 Training the practicing chemist
- 4 Industrial considerations--information technology and its effect on corporate culture
- 5 Computing & communications in chemistry education
- Part 2 Accessing chemical information
- 6 Information retrieval in chemistry across the internet
- 7 Coping with the transformation of chemical information
- Part 3 Fundamental computer skills in modern chemical practice
- 8 Beyond the basics: what chemistry students need to know about computing
- 9 Spreadsheets for doing and teaching chemistry
- 10 Software for teaching and using numerical methods in physical chemistry
- 11 A framework for the teaching of computer-instrument interfacing
- 12 Statistical methods in chemistry: what and how they should be integrated into the curriculum
- 13 Visualization for chemists
- Part 4 Computational chemistry in the curriculum
- 14 Ab initio techniques in chemistry: interpretation and visualization
- 15 Computer chemistry: a curse or the way of the future?
- 16 Molecular graphics and simulation of proteins and nucleic acids
- 17 Molecular modeling and drug design
- Part 5 Teaching chemistry with computers
- 18 Teaching organic chemistry on-line--the promise and the reality
- 19 Computer-assisted instruction in chemistry