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Journal Abstract Search


302 related items for PubMed ID: 16509572

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  • 3. Comparison of structure- and ligand-based virtual screening protocols considering hit list complementarity and enrichment factors.
    Krüger DM, Evers A.
    ChemMedChem; 2010 Jan; 5(1):148-58. PubMed ID: 19908272
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  • 7. Virtual screening and scaffold hopping based on GRID molecular interaction fields.
    Ahlström MM, Ridderström M, Luthman K, Zamora I.
    J Chem Inf Model; 2005 Jan; 45(5):1313-23. PubMed ID: 16180908
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  • 8. Comparison of ligand- and structure-based virtual screening on the DUD data set.
    von Korff M, Freyss J, Sander T.
    J Chem Inf Model; 2009 Feb; 49(2):209-31. PubMed ID: 19434824
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  • 10. Fast structure-based virtual ligand screening combining FRED, DOCK, and Surflex.
    Miteva MA, Lee WH, Montes MO, Villoutreix BO.
    J Med Chem; 2005 Sep 22; 48(19):6012-22. PubMed ID: 16162004
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  • 11. Novel lead structures for p38 MAP kinase via FieldScreen virtual screening.
    Cheeseright TJ, Holm M, Lehmann F, Luik S, Göttert M, Melville JL, Laufer S.
    J Med Chem; 2009 Jul 23; 52(14):4200-9. PubMed ID: 19489590
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  • 13. Bridging chemical and biological space: "target fishing" using 2D and 3D molecular descriptors.
    Nettles JH, Jenkins JL, Bender A, Deng Z, Davies JW, Glick M.
    J Med Chem; 2006 Nov 16; 49(23):6802-10. PubMed ID: 17154510
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  • 14. E-novo: an automated workflow for efficient structure-based lead optimization.
    Pearce BC, Langley DR, Kang J, Huang H, Kulkarni A.
    J Chem Inf Model; 2009 Jul 16; 49(7):1797-809. PubMed ID: 19552372
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  • 15. Molecular surface point environments for virtual screening and the elucidation of binding patterns (MOLPRINT 3D).
    Bender A, Mussa HY, Gill GS, Glen RC.
    J Med Chem; 2004 Dec 16; 47(26):6569-83. PubMed ID: 15588092
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  • 16. New scoring functions for virtual screening from molecular dynamics simulations with a quantum-refined force-field (QRFF-MD). Application to cyclin-dependent kinase 2.
    Ferrara P, Curioni A, Vangrevelinghe E, Meyer T, Mordasini T, Andreoni W, Acklin P, Jacoby E.
    J Chem Inf Model; 2006 Dec 16; 46(1):254-63. PubMed ID: 16426061
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  • 17. BREED: Generating novel inhibitors through hybridization of known ligands. Application to CDK2, p38, and HIV protease.
    Pierce AC, Rao G, Bemis GW.
    J Med Chem; 2004 May 20; 47(11):2768-75. PubMed ID: 15139755
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  • 18. SHOP: receptor-based scaffold HOPping by GRID-based similarity searches.
    Bergmann R, Liljefors T, Sørensen MD, Zamora I.
    J Chem Inf Model; 2009 Mar 20; 49(3):658-69. PubMed ID: 19265417
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  • 19. Structure-based virtual screening with supervised consensus scoring: evaluation of pose prediction and enrichment factors.
    Teramoto R, Fukunishi H.
    J Chem Inf Model; 2008 Apr 20; 48(4):747-54. PubMed ID: 18318474
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  • 20. Improving structure-based virtual screening by multivariate analysis of scoring data.
    Jacobsson M, Lidén P, Stjernschantz E, Boström H, Norinder U.
    J Med Chem; 2003 Dec 18; 46(26):5781-9. PubMed ID: 14667231
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