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ORCIDJournal of Chemical Information and Computer Sciences, Volume 23
Volume 23, Number 1, February 1983
- S. Barrie Walker:
Development of CAOCI and its use in ICI plant protection division. 3-5 - Svante Wold, William J. Dunn:
Multivariate quantitative structure-activity relationships (QSAR): conditions for their applicability. 6-13 - David Bawden:
Computerized chemical structure-handling techniques in structure-activity studies and molecular property prediction. 14-22 - Peter Willett:
Some heuristics for nearest-neighbor searching in chemical structure files. 22-25 - F. Choplin, S. Goundiam, Gérard Kaufmann:
Storage and retrieval of synthetic trees. 26-30 - David J. Craik
, Anil Kumar, George C. Levy:
MOLDYN: a generalized program for the evaluation of molecular dynamics models using nuclear magnetic resonance spin-relaxation data. 30-38 - Judith M. Hushon, John Powell, William G. Town:
Summary of the history and status of the system development for the Environmental Chemicals Data and Information Network (ECDIN). 38-43 - Andrea L. Fella, James G. Nourse, Dennis H. Smith:
Conformation specification of chemical structures in computer programs. 43-47 - John Figueras:
Chemical symbol string parser. 48-52 - Masaru Imai, Takeshi Iizuka, Tadayoshi Kan:
Computational method to obtain the F matrix for an arbitrary molecular force field and the B matrix for any molecular structure. 53-56
Volume 23, Number 2, May 1983
- G. H. Kirby, Susan Milward:
Syntax to facilitate the word processing of chemical formulas. 57-60 - Craig A. Shelley:
Heuristic approach for displaying chemical structures. 61-65 - Guenter Bergerhoff, R. Hundt, R. Sievers, I. D. Brown:
The inorganic crystal structure data base. 66-69 - John T. Dickman, Gerard O. Platau:
Foreign literature challenges to Chemical Abstracts Service. 70-73 - Ionel Haiduc:
Coverage of inorganic heterocycles in Chemical Abstracts. 74-78 - H. D. Brown:
A pharmaceutical information manager's viewpoint on R&D information resource management. 78-80 - Takashi Nakayama, Yuzuru Fujiwara:
Computer representation of generic chemical structures by an extended block-cutpoint tree. 80-87
Volume 23, Number 3, August 1983
- John C. Marshall:
Micro computer software. 1. After FORTRAN. 91-92 - Paul G. Dittmar, Nick A. Farmer, William Fisanick, Reginald C. Haines, Joseph Mockus:
The CAS ONLINE search system. 1. General system design and selection, generation, and use of search screens. 93-102 - Roger Attias:
DARC substructure search system: a new approach to chemical information. 102-108 - Yoshihiro Kudo, Hideaki Chihara:
Chemical substance retrieval system for searching generic representations. 1. A prototype system for the gazetted list of Existing Chemical Substances of Japan. 109-117 - John E. Gordon, Joyce C. Brockwell:
Chemical inference. 1. Formalization of the language of organic chemistry: generic structural formulas. 117-134 - Ronald C. Read:
A new system for the designation of chemical compounds. 1. Theoretical preliminaries and the coding of acyclic compounds. 135-149
Volume 23, Number 4, November 1983
- Charles S. Johnson:
Computer algebra in chemistry. 151-157 - David Eckroth:
Nitrogen's hydrido oxo acids. 157-159 - P. J. Pollick:
Selection of patents for the Chemical Abstracts Service data base. 160-165 - Robert A. Simons:
Information services providers: copyright issues for the eighties. 165-167 - Barbara Friedman Polansky:
International recommendations for handling copyright questions about computer-generated works: what are our concerns? 168-171 - James B. Hendrickson, A. Glenn Toczko:
Unique numbering and cataloging of molecular structures. 171-177 - Nobuhide Tanaka, Tadayoshi Kan, Takeshi Iizuka:
A reasonable triamantane rearrangement path searched by the selective disource propagation algorithm. 177-182 - Gloria W. Sage, Anthony B. LaMacchia:
A simple algorithm for sorting chemical names. 183-186 - Christopher W. Crandell, Dennis H. Smith:
Computer-assisted examination of compounds for common three-dimensional substructures. 186-197 - H. N. Cheng, S. J. Ellingsen:
Carbon-13 nuclear magnetic resonance spectral interpretation by a computerized substituent chemical shift method. 197-203
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