Works in Journal of Computer-Aided Molecular Design, 2011, Vol 25, Issue 1
Results: 7
In silico strategies for the selection of chelating compounds with potential application in metal-promoted neurodegenerative diseases.
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- Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 1, p. 21, doi. 10.1007/s10822-010-9396-7
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- Article
Toward better QSAR/QSPR modeling: simultaneous outlier detection and variable selection using distribution of model features.
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- Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 1, p. 67, doi. 10.1007/s10822-010-9401-1
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- Article
Computer-aided drug design platform using PyMOL.
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- Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 1, p. 13, doi. 10.1007/s10822-010-9395-8
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- Article
Challenges in the determination of the binding modes of non-standard ligands in X-ray crystal complexes.
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- Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 1, p. 1, doi. 10.1007/s10822-010-9397-6
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- Article
Computer-assisted combinatorial design of bicyclic thymidine analogs as inhibitors of Mycobacterium tuberculosis thymidine monophosphate kinase.
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- Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 1, p. 31, doi. 10.1007/s10822-010-9399-4
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Theoretical studies on the interaction of partial agonists with the 5-HT receptor.
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- Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 1, p. 51, doi. 10.1007/s10822-010-9400-2
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Molecular and structural determinants of adamantyl susceptibility to HLA-DRs allelic variants: an in silico approach to understand the mechanism of MLEs.
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- Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 1, p. 81, doi. 10.1007/s10822-010-9404-y
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- Article