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Volumn 2, Issue 7, 2007, Pages 1037-1042

Apparent asymmetry in fingerprint similarity searching is a direct consequence of differences in bit densities and molecular size

Author keywords

Chemoinformatics; Fingerprints; Molecular similarity; Tversky coefficients; Virtual screening

Indexed keywords

ARTICLE; CHEMICAL STRUCTURE; INFORMATION RETRIEVAL;

EID: 39449090192     PISSN: 18607179     EISSN: 18607187     Source Type: Journal    
DOI: 10.1002/cmdc.200700050     Document Type: Article
Times cited : (24)

References (18)
  • 13
    • 54849441818 scopus 로고    scopus 로고
    • Molecular Drug Data Report (MDDR), MDL Elsevier, San Leandro, CA (USA) 2005 (http://www.mdl.com).
    • Molecular Drug Data Report (MDDR), MDL Elsevier, San Leandro, CA (USA) 2005 (http://www.mdl.com).
  • 15
    • 54849438512 scopus 로고    scopus 로고
    • The publicly available NCI anti-AIDS database contains structure-activity data for the compounds screened by the National Cancer Institute AIDS antiviralscreen ing program, 1999
    • The publicly available NCI anti-AIDS database contains structure-activity data for the compounds screened by the National Cancer Institute AIDS antiviralscreen ing program, 1999 (http://dtp.nci.nih.gov/docs/aids/ aids_data.html).
  • 16
    • 54549102683 scopus 로고    scopus 로고
    • MACCS structural keys, San Leandro, CA USA
    • MACCS structural keys, MDL Elsevier, San Leandro, CA (USA) 2005 (http://www.mdl.com).
    • (2005) MDL Elsevier
  • 17
    • 3042549719 scopus 로고    scopus 로고
    • The TGD fingerprint is available in the Molecular Operating Environment (MOE, Montreal, QC Canada
    • The TGD fingerprint is available in the Molecular Operating Environment (MOE), Chemical Computing Group Inc., Montreal, QC (Canada) 2005 (http://www.chemcomp.com).
    • (2005) Chemical Computing Group Inc


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.