Managing the Combinatorial Explosion
Computer software designed to deal with the large amounts of data generated by chemical and biological research programs is described. The software includes methods for representation of the structural components of combinatorial libraries, enumeration of structures and structure-based searches, and...
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Veröffentlicht in: | Journal of Chemical Information and Computer Sciences 1997-01, Vol.37 (1), p.62-70 |
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container_title | Journal of Chemical Information and Computer Sciences |
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creator | Leland, Burton A Christie, Bradley D Nourse, James G Grier, David L Carhart, Raymond E Maffett, Tim Welford, Steve M Smith, Dennis H |
description | Computer software designed to deal with the large amounts of data generated by chemical and biological research programs is described. The software includes methods for representation of the structural components of combinatorial libraries, enumeration of structures and structure-based searches, and comparisons within combinatorial libraries. |
doi_str_mv | 10.1021/ci960088t |
format | Article |
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issn | 0095-2338 1549-960X 1520-5142 |
language | eng |
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source | ACS Publications |
subjects | chemical structure Chemical structures combinatorial libraries computer software Computerized information storage and retrieval information retrieval information systems Markush structures Searching |
title | Managing the Combinatorial Explosion |
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