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OLS Field Name OLS Field Data
Main Title Algorithms for chemical computations : a symposium /
Author Christoffersen, Ralph E.
Other Authors
Author Title of a Work
Christoffersen, Ralph E.
CORP Author American Chemical Society. Division of Computers in Chemistry.
Publisher American Chemical Society,
Year Published 1977
OCLC Number 02873773
ISBN 0841203717; 9780841203716
Subjects Chemistry--Data processing--Congresses. ; Algorithms--Congresses.
Additional Subjects Chemistry--Data processing--Congresses ; Algorithms--Congresses
Internet Access
Description Access URL
http://pubs.acs.org/doi/book/10.1021/bk-1977-0046
Holdings
Library Call Number Additional Info Location Last
Modified
Checkout
Status
ELBM  QD39.3.E46A43 1977 AWBERC Library/Cincinnati,OH 01/31/1997
Collation viii, 151 pages : illustrations ; 24 cm.
Notes
Symposium actually held at the 172nd meeting of the American Chemical Society, San Francisco.--Pref. Includes bibliographical references and index.
Contents Notes
Graph algorithms in chemical computation / Robert Endre Tarjan -- Algorithm design in computational quantum chemistry / Ernest R. Davidson -- Rational selection of algorithms for molecular scattering calculations / Roy G. Gordon -- Molecular dynamics and transition state theory : the simulation of infrequent events / Charles H. Bennett -- Newer computing techniques for molecular structure studies by X-ray crystallography / David J. Duchamp -- Algorithms in the computer handling of chemical information / Louis J. O'Korn.