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Pubmed for Handhelds

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Journal Abstract Search

192 related items for PubMed ID: 17824684

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  • 5. "Bayes affinity fingerprints" improve retrieval rates in virtual screening and define orthogonal bioactivity space: when are multitarget drugs a feasible concept?
    Bender A, Jenkins JL, Glick M, Deng Z, Nettles JH, Davies JW.
    J Chem Inf Model; 2006; 46(6):2445-56. PubMed ID: 17125186
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  • 6. Neighborhood behavior: a useful concept for validation of "molecular diversity" descriptors.
    Patterson DE, Cramer RD, Ferguson AM, Clark RD, Weinberger LE.
    J Med Chem; 1996 Aug 02; 39(16):3049-59. PubMed ID: 8759626
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  • 8. Molecular similarity concepts and search calculations.
    Auer J, Bajorath J.
    Methods Mol Biol; 2008 Aug 02; 453():327-47. PubMed ID: 18712312
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  • 10. Bit silencing in fingerprints enables the derivation of compound class-directed similarity metrics.
    Wang Y, Bajorath J.
    J Chem Inf Model; 2008 Sep 02; 48(9):1754-9. PubMed ID: 18698839
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  • 16. Neighborhood behavior of in silico structural spaces with respect to in vitro activity spaces-a novel understanding of the molecular similarity principle in the context of multiple receptor binding profiles.
    Horvath D, Jeandenans C.
    J Chem Inf Comput Sci; 2003 Sep 02; 43(2):680-90. PubMed ID: 12653538
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  • 20. Development of a spectral clustering method for the analysis of molecular data sets.
    Brewer ML.
    J Chem Inf Model; 2007 Sep 02; 47(5):1727-33. PubMed ID: 17636944
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