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Identification of novel inhibitors for Pim-1 kinase using pharmacophore modeling based on a novel method for selecting pharmacophore generation subsets.
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- Journal of Computer-Aided Molecular Design, 2016, v. 30, n. 1, p. 39, doi. 10.1007/s10822-015-9887-7
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- Article
Computational insights into the interaction mechanism of triazolyl substituted tetrahydrobenzofuran derivatives with H,K-ATPase at different pH.
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- Journal of Computer-Aided Molecular Design, 2016, v. 30, n. 1, p. 27, doi. 10.1007/s10822-015-9886-8
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- Article
Unraveling the distinctive features of hemorrhagic and non-hemorrhagic snake venom metalloproteinases using molecular simulations.
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- Journal of Computer-Aided Molecular Design, 2016, v. 30, n. 1, p. 69, doi. 10.1007/s10822-015-9889-5
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- Article
New insights into the stereochemical requirements of the bradykinin B receptor antagonists binding.
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- Journal of Computer-Aided Molecular Design, 2016, v. 30, n. 1, p. 85, doi. 10.1007/s10822-015-9890-z
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- Article
Design of chemical space networks on the basis of Tversky similarity.
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- Journal of Computer-Aided Molecular Design, 2016, v. 30, n. 1, p. 1, doi. 10.1007/s10822-015-9891-y
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- Article
Theoretical studies on the reaction of mono- and ditriflate derivatives of 1,4:3,6-dianhydro- d-mannitol with trimethylamine-Can a quaternary ammonium salt be a source of the methyl group?
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- Journal of Computer-Aided Molecular Design, 2016, v. 30, n. 1, p. 13, doi. 10.1007/s10822-015-9885-9
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- Article