DivCalc: A utility for diversity analysis and compound sampling

Molecules

Volumn 7, Issue 8, 2002, Pages 657-661

  Gangal, Rajeev ^a  

^a SciNova Informatics   (India)

Author keywords

Combinatorial chemistry; DISSIM; Dissimilarity; Diversity; HTS; Software

Indexed keywords

ARTICLE; CALCULATION; CHEMICAL ANALYSIS; COMBINATORIAL CHEMISTRY; COMPUTER PROGRAM; DRUG RESEARCH; GENETIC VARIABILITY; HIGH THROUGHPUT SCREENING; SAMPLING; SCIENCE;

EID: 3242879747     PISSN: 14203049     EISSN: None     Source Type: Journal    
DOI: 10.3390/70800657     Document Type: Article

References (6)

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2. Van Drie, J. H.; Lajiness M. S. Approaches to virtual library design. DDT, 1998, 3, 274-283.
3. Linusson, A.; Gottfries, J.; Lindgren, F.; Wold S. Statistical Molecular Design of Building Blocks for Combinatorial Chemistry. J. Med. Chem., 2000, 43, 1320-1328.
4. Leach, A. R.; Hann, M. M. The in silico world of virtual libraries. DDT, 2000, 5, 326-336.
5. Gorse, D.; Rees, A.; Kaczorek, M; Lahana, R. Molecular Diversity and its analysis. DDT, 1999, 4, 257-385.
6. Todeschini, R; Consonni, V. Handbook of Molecular Descriptors; Wiley-VCH: Weinheim (Germany), 2000; vol. 11, pp. 667.