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Volumn 16, Issue 1, 1998, Pages 11-13

World Wide Web-based system for the calculation of substituent parameters and substituent similarity searches

Author keywords

Bioisosterism; QSAR; Substituent constants; Substituent parameters; World Wide Web

Indexed keywords

COMPUTATIONAL METHODS; COMPUTER SIMULATION; ELECTRONIC PROPERTIES; HTML; HYDROPHOBICITY; INTERACTIVE COMPUTER GRAPHICS; INTERACTIVE COMPUTER SYSTEMS; JAVA PROGRAMMING LANGUAGE; MOLECULAR STRUCTURE; WORLD WIDE WEB;

EID: 0032008462     PISSN: 10933263     EISSN: None     Source Type: Journal    
DOI: 10.1016/S1093-3263(98)00012-6     Document Type: Article
Times cited : (32)

References (15)
  • 2
    • 0002136350 scopus 로고
    • Classical and Three-Dimensional QSAR in Agrochemistry
    • (eds). D.C.: Washington
    • Hansch C., Fujita T. (eds. ). Classical and Three-Dimensional QSAR in Agrochemistry. ACS. 1995;13-44 Washington, D.C.
    • (1995) ACS , pp. 13-44
    • Hansch, C.1    Fujita, T.2
  • 4
    • 0013624168 scopus 로고
    • Sun Microsystems
    • Sun Microsystems. What Is Java? http://java.sun.com, 1995.
    • (1995) What Is Java?
  • 5
    • 0030265473 scopus 로고    scopus 로고
    • The World Wide Web as a graphical user interface to program macros for molecular graphics, molecular modelling and structure based drug design
    • Taylor N.R., Smith R. The World Wide Web as a graphical user interface to program macros for molecular graphics, molecular modelling and structure based drug design. J. Mol. Graphics. 14:1996;291-296.
    • (1996) J. Mol. Graphics , vol.14 , pp. 291-296
    • Taylor, N.R.1    Smith, R.2
  • 7
    • 0347874842 scopus 로고    scopus 로고
    • WWW-based chemical information system
    • see also
    • Ertl, P. and Jacob, O. WWW-based chemical information system. THEOCHEM 1997, 419, 113-120; see also http://www.elsevier.com/homepage/saa/eccc3/paper6.
    • (1997) THEOCHEM , vol.419 , pp. 113-120
    • Ertl, P.1    Jacob, O.2
  • 8
    • 84911792416 scopus 로고
    • Atomic physicochemical parameters for three dimensional structure directed quantitative structure-activity relationships. III
    • Ghose A.K., Pritchett A., Crippen G.M. Atomic physicochemical parameters for three dimensional structure directed quantitative structure-activity relationships. III. J. Comput. Chem. 9:1988;80-90.
    • (1988) J. Comput. Chem. , vol.9 , pp. 80-90
    • Ghose, A.K.1    Pritchett, A.2    Crippen, G.M.3
  • 9
    • 0024716284 scopus 로고
    • Atomic physicochemical parameters for three dimensional structure directed quantitative structure-activity relationships. IV
    • Viswanadhan V.M., Ghose A.K., Revankar G.R., Robins R.K. Atomic physicochemical parameters for three dimensional structure directed quantitative structure-activity relationships. IV. J. Chem. Inf. Comput. Sci. 29:1989;163-172.
    • (1989) J. Chem. Inf. Comput. Sci. , vol.29 , pp. 163-172
    • Viswanadhan, V.M.1    Ghose, A.K.2    Revankar, G.R.3    Robins, R.K.4
  • 10
    • 0030670402 scopus 로고    scopus 로고
    • Simple quantum chemical parameters as an alternative to the Hammett sigma constants in QSAR studies
    • Ertl P. Simple quantum chemical parameters as an alternative to the Hammett sigma constants in QSAR studies. Quant. Struct.-Act. Relat. 16:1997;377-382.
    • (1997) Quant. Struct.-Act. Relat. , vol.16 , pp. 377-382
    • Ertl, P.1
  • 11
    • 0023965741 scopus 로고
    • SMILES, a chemical language and information system
    • Weininger D. SMILES, a chemical language and information system. J. Chem. Inf. Comput. Sci. 28:1988;31-36.
    • (1988) J. Chem. Inf. Comput. Sci. , vol.28 , pp. 31-36
    • Weininger, D.1
  • 12
    • 0000490166 scopus 로고
    • From atoms and bonds to three-dimensional atomic coordinates: Automatic model builders
    • Sadowski J., Gasteiger J. From atoms and bonds to three-dimensional atomic coordinates Automatic model builders . Chem. Rev. 93:1993;2567-2581.
    • (1993) Chem. Rev. , vol.93 , pp. 2567-2581
    • Sadowski, J.1    Gasteiger, J.2
  • 15
    • 0031472820 scopus 로고    scopus 로고
    • Structure-based selection of building blocks for array synthesis via the World-Wide Web
    • Leach A.R. Structure-based selection of building blocks for array synthesis via the World-Wide Web. J. Mol. Graphics Modelling. 15:1997;158-160.
    • (1997) J. Mol. Graphics Modelling , vol.15 , pp. 158-160
    • Leach, A.R.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.