Computer storage and retrieval of generic chemical structures in patents. 5. Algorithmic generation of fragment descriptors for generic structure screening

Considerations for the use of limited-environment screens for screening generic chemical structures are discussed. The general strategy and detailed procedures for the automatic generation of screens from the extended connection table representation (ECTR) of generic chemical structures are describe...

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Published inJournal of chemical information and computer sciences Vol. 24; no. 2; pp. 57 - 66
Main Authors Welford, Stephen M, Lynch, Michael F, Barnard, John M
Format Journal Article
LanguageEnglish
Published American Chemical Society 01.05.1984
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ISSN0095-2338
1520-5142
DOI10.1021/ci00042a003

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Summary:Considerations for the use of limited-environment screens for screening generic chemical structures are discussed. The general strategy and detailed procedures for the automatic generation of screens from the extended connection table representation (ECTR) of generic chemical structures are described. A bitscreen record for generic data base structures and specific, generic, and substructure queries is described, and a number of screening algorithms are proposed.
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ark:/67375/TPS-T85X2HKJ-4
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content type line 23
ISSN:0095-2338
1520-5142
DOI:10.1021/ci00042a003