03142nam 22006375 450 991073373510332120230613071544.03-030-14632-410.1007/978-3-030-14632-0(CKB)4100000009590427(MiAaPQ)EBC5962822(DE-He213)978-3-030-14632-0(PPN)258061561(EXLCZ)99410000000959042720191016d2019 u| 0engurcnu||||||||txtrdacontentcrdamediacrrdacarrierProgress in the Chemistry of Organic Natural Products 110 Cheminformatics in Natural Product Research /edited by A. Douglas Kinghorn, Heinz Falk, Simon Gibbons, Jun'ichi Kobayashi, Yoshinori Asakawa, Ji-Kai Liu1st ed. 2019.Cham :Springer International Publishing :Imprint: Springer,2019.1 online resource (274 pages)Progress in the Chemistry of Organic Natural Products,2192-4309 ;1103-030-14631-6 Resources for chemical, biological, and structural data on natural product -- The pharmacophore concept and its applications in computer-aided drug design -- Chemical space of natural products -- Cheminformatics analysis for natural product fragments -- A toolbox for the identification of modes of action of natural products -- A SWOT analysis of Cheminformatics in natural product research -- Open access prediction tools for natural products. Case study: hERG blockers.The book summarizes important aspects of cheminformatics that are relevant for natural product research. It highlights cheminformatics tools that help to match natural products with their respective biological targets or off-targets, and discusses the potential and limitations of this approach.Progress in the Chemistry of Organic Natural Products,2192-4309 ;110Chemistry, OrganicPharmaceutical chemistryPharmaceutical chemistryOrganic ChemistryPharmaceuticsMedicinal ChemistryChemistry, Organic.Pharmaceutical chemistry.Pharmaceutical chemistry.Organic Chemistry.Pharmaceutics.Medicinal Chemistry.542.85542.85Kinghorn A. Douglasedthttp://id.loc.gov/vocabulary/relators/edtFalk Heinzedthttp://id.loc.gov/vocabulary/relators/edtGibbons Simonedthttp://id.loc.gov/vocabulary/relators/edtKobayashi Jun'ichiedthttp://id.loc.gov/vocabulary/relators/edtAsakawa Yoshinoriedthttp://id.loc.gov/vocabulary/relators/edtLiu Ji-Kaiedthttp://id.loc.gov/vocabulary/relators/edtMiAaPQMiAaPQMiAaPQBOOK9910733735103321Progress in the Chemistry of Organic Natural Products 1101668176UNINA