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Small molecule drug discovery bioinformatics

To support drug discovery efficiently, the biological information derived in bioinformatics needs to be combined with chemical data in order to facilitate the identification of lead structures and the development of small molecules as active pharmaceuticals. To this end, different databases need to be brought together for the integration of disparate re-sults.t ... [Pg.162]

Chen J, Swamidass SJ, Dou Y, Bruand J, Baldi P (2005) ChemBD a public database of small molecules and related chemoinformatics resources. Bioinformatics 21 4133-4139 DrugBank http //www.drugbank.ca. Accessed 1 Feb 2014 WOMBAT http //www.sunsetmolecular.com/. Accessed 1 Feb 2014 MDDR http //accelrys.com/products/databases/bioactivity/mddr.html. Accessed 1 Feb 2014 Scior JT, Bernard P, Medina-Franco JL, Maggiora GM (2007) Large compound databases for structure-activity relationships studies in drug discovery. Mini Rev Med Chem 7 851-860 Leach AR, Gillet VJ (2003) An introduction to chemoinformatics. Kluwer Academic, Dordrecht... [Pg.73]

See other pages where Small molecule drug discovery bioinformatics is mentioned: [Pg.248]    [Pg.1772]    [Pg.626]    [Pg.176]    [Pg.587]    [Pg.126]    [Pg.336]    [Pg.4014]    [Pg.380]    [Pg.272]    [Pg.528]    [Pg.495]    [Pg.34]   
See also in sourсe #XX -- [ Pg.65 , Pg.66 , Pg.67 , Pg.68 ]



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