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Volumn 42, Issue 1, 2002, Pages 64-70

A new method for fast and accurate derivation of molecular conformations

Author keywords

[No Author keywords available]

Indexed keywords

MOLECULAR CONFORMATIONS;

EID: 0036429763     PISSN: 00952338     EISSN: None     Source Type: Journal    
DOI: 10.1021/ci010327z     Document Type: Article
Times cited : (68)

References (12)
  • 4
    • 0000281282 scopus 로고    scopus 로고
    • Computational approaches to drug design
    • Finn, P.W.; Kavraki, L.E. Computational Approaches to Drug Design. Algorithmica 1999, 25, 347-371.
    • (1999) Algorithmica , vol.25 , pp. 347-371
    • Finn, P.W.1    Kavraki, L.E.2
  • 7
    • 0011418296 scopus 로고    scopus 로고
    • Conformational flexibility in 3D structure searching
    • Schleyer, P.v.R., Ed.; Wiley: New York
    • Henry, D.R.; Ozkabak, A.G. Conformational Flexibility in 3D Structure Searching. Encyclopedia of Computational Chemistry; Schleyer, P.v.R., Ed.; Wiley: New York, 1998.
    • (1998) Encyclopedia of Computational Chemistry
    • Henry, D.R.1    Ozkabak, A.G.2
  • 9
    • 0001082936 scopus 로고    scopus 로고
    • Randomized kinematics-based approach to pharmacophore-constrained conformational search and database screening
    • Lavalle, S.M.; Finn, P.W.; Kavraki, L.E.; Latombe, Jean-Claude. A Randomized Kinematics-based Approach to Pharmacophore-Constrained Conformational Search and Database Screening. J. Comput. Chem. 2000, 21, No. 9, 731-747.
    • (2000) J. Comput. Chem. , vol.21 , Issue.9 , pp. 731-747
    • Lavalle, S.M.1    Finn, P.W.2    Kavraki, L.E.3    Latombe, J.-C.A.4
  • 10
    • 84988075077 scopus 로고    scopus 로고
    • The multiple minimum problem in molecular modeling. Tree searching internal coordinate conformational space
    • Lipton, M.; Still, W. The Multiple Minimum Problem in Molecular Modeling. Tree Searching Internal Coordinate Conformational Space. J. Comput. Chem. 1998, 9, 343-355.
    • (1998) J. Comput. Chem. , vol.9 , pp. 343-355
    • Lipton, M.1    Still, W.2
  • 11
    • 0029277503 scopus 로고
    • Analysis of conformational coverage. 1: Validation and estimation of coverage
    • Smellie, A.; Kahn, S.D.; Teig, S.L. Analysis of Conformational Coverage. 1. Validation and Estimation of Coverage. J. Chem. Inf. Comput. Sci. 1995, 35, 285-294.
    • (1995) J. Chem. Inf. Comput. Sci. , vol.35 , pp. 285-294
    • Smellie, A.1    Kahn, S.D.2    Teig, S.L.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.