Works in Journal of Computer-Aided Molecular Design, 2012, Vol 26, Issue 4
Results: 7
A collaborative environment for developing and validating predictive tools for protein biophysical characteristics.
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- Journal of Computer-Aided Molecular Design, 2012, v. 26, n. 4, p. 387, doi. 10.1007/s10822-012-9564-z
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- Article
Sialyldisaccharide conformations: a molecular dynamics perspective.
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- Journal of Computer-Aided Molecular Design, 2012, v. 26, n. 4, p. 375, doi. 10.1007/s10822-012-9563-0
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- Article
The state of the guanosine nucleotide allosterically affects the interfaces of tubulin in protofilament.
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- Journal of Computer-Aided Molecular Design, 2012, v. 26, n. 4, p. 397, doi. 10.1007/s10822-012-9566-x
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- Article
Virtual screening using a conformationally flexible target protein: models for ligand binding to p38α MAPK.
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- Journal of Computer-Aided Molecular Design, 2012, v. 26, n. 4, p. 409, doi. 10.1007/s10822-012-9569-7
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- Article
Structure-based design of oxygen-linked macrocyclic kinase inhibitors: discovery of SB1518 and SB1578, potent inhibitors of Janus kinase 2 (JAK2) and Fms-like tyrosine kinase-3 (FLT3).
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- Journal of Computer-Aided Molecular Design, 2012, v. 26, n. 4, p. 437, doi. 10.1007/s10822-012-9572-z
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- Article
On the active site of mononuclear B1 metallo β-lactamases: a computational study.
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- Journal of Computer-Aided Molecular Design, 2012, v. 26, n. 4, p. 425, doi. 10.1007/s10822-012-9571-0
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- Article
Development and validation of an improved algorithm for overlaying flexible molecules.
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- Journal of Computer-Aided Molecular Design, 2012, v. 26, n. 4, p. 451, doi. 10.1007/s10822-012-9573-y
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- Article