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Volumn 1, Issue 1, 1998, Pages 16-27

Combinatorial and computational approaches in structure-based drug design

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0002716825     PISSN: 13676733     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article
Times cited : (90)

References (127)
  • 7
    • 33746478792 scopus 로고    scopus 로고
    • The Web page httptfw\vw.biochem.ucl.ac.uk/bsm/pdbsum/allows one to search, view and download protein 3D structures and ligand geometries from the Brookhaven Protein Databank (7,519 entries; effective April 5, 1998), including valuable information, such as active site amino acids, secondary structures, MOLSCRIPTand LIGPLOT diagrams
    • The Web page httptfw\vw.biochem.ucl.ac.uk/bsm/pdbsum/allows one to search, view and download protein 3D structures and ligand geometries from the Brookhaven Protein Databank (7,519 entries; effective April 5, 1998), including valuable information, such as active site amino acids, secondary structures, MOLSCRIPTand LIGPLOT diagrams.
  • 13
    • 33746573495 scopus 로고    scopus 로고
    • Comprehensive review of synthetic methods and other aspects of combinatorial chemistry, including about 600 references and many practice-oriented comments in footnotes
    • Comprehensive review of synthetic methods and other aspects of combinatorial chemistry, including about 600 references and many practice-oriented comments in footnotes.
  • 15
    • 33746483579 scopus 로고    scopus 로고
    • Use of three-point pharmacophores for assessing diversity and for combinatorial library design
    • Use of three-point pharmacophores for assessing diversity and for combinatorial library design.
  • 20
    • 33746473174 scopus 로고    scopus 로고
    • Describes the application of a genetic algorithm to optimizing the diversity of libraries while minimizing the effort required to deconvolute the biological hits
    • Describes the application of a genetic algorithm to optimizing the diversity of libraries while minimizing the effort required to deconvolute the biological hits.
  • 26
    • 0347543977 scopus 로고    scopus 로고
    • (1998) 3:105-112. b. Pearlman RS, Smith KM: Novel software tools for chemical diversity. In: 3D QSAR in drug design. Volume 2. LJgand-protein interactions and molecular similarity, Kubinyi H, Folkers G, Martin YC (Eds). Kluwer Academic Publishers, Dordrecht (1993):339-353.
    • Drug Discovery Today (1998) 3:105-112. b. Pearlman RS, Smith KM: Novel software tools for chemical diversity. In: 3D QSAR in drug design. Volume 2. LJgand-protein interactions and molecular similarity, Kubinyi H, Folkers G, Martin YC (Eds). Kluwer Academic Publishers, Dordrecht (1993):339-353.
    • Drug Discovery Today
  • 33
    • 33746480495 scopus 로고    scopus 로고
    • Solid phase synthesis of a structurally diverse set 200 amides, selected from > 2,200 acid components
    • Solid phase synthesis of a structurally diverse set 200 amides, selected from > 2,200 acid components.
  • 47
    • 33746518196 scopus 로고    scopus 로고
    • trypsin binding site.
    • Selection and self-assembly of boronic add esters at the trypsin binding site.
  • 58
    • 33746574706 scopus 로고    scopus 로고
    • Describes a six-month program to discover a nanomolar ligand of the matrix metalloproteinase, stromelysin (see Figure 2)
    • Describes a six-month program to discover a nanomolar ligand of the matrix metalloproteinase, stromelysin (see Figure 2).
  • 70
    • 33746496916 scopus 로고    scopus 로고
    • Several chapters cover computational techniques to process 3D structures of small molecules, 3D database searching, SAR by pharmacophore mapping and 3D QSAR, docking and de novo design
    • Several chapters cover computational techniques to process 3D structures of small molecules, 3D database searching, SAR by pharmacophore mapping and 3D QSAR, docking and de novo design.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.