Works matching IS 0920-654X AND VI 28 AND IP 7 AND DT 2014
Results: 7
Temperature effect on poly(dA).poly(dT): molecular dynamics simulation studies of polymeric and oligomeric constructs.
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- Journal of Computer-Aided Molecular Design, 2014, v. 28, n. 7, p. 735, doi. 10.1007/s10822-014-9755-x
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- Article
Ensemble pharmacophore meets ensemble docking: a novel screening strategy for the identification of RIPK1 inhibitors.
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- Journal of Computer-Aided Molecular Design, 2014, v. 28, n. 7, p. 779, doi. 10.1007/s10822-014-9771-x
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- Article
Molecular insight of isotypes specific β-tubulin interaction of tubulin heterodimer with noscapinoids.
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- Journal of Computer-Aided Molecular Design, 2014, v. 28, n. 7, p. 751, doi. 10.1007/s10822-014-9756-9
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Structural insight into exosite binding and discovery of novel exosite inhibitors of botulinum neurotoxin serotype A through in silico screening.
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- Journal of Computer-Aided Molecular Design, 2014, v. 28, n. 7, p. 765, doi. 10.1007/s10822-014-9758-7
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Ligand efficiency metrics considered harmful.
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- Journal of Computer-Aided Molecular Design, 2014, v. 28, n. 7, p. 699, doi. 10.1007/s10822-014-9757-8
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- Article
FreeSolv: a database of experimental and calculated hydration free energies, with input files.
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- Journal of Computer-Aided Molecular Design, 2014, v. 28, n. 7, p. 711, doi. 10.1007/s10822-014-9747-x
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- Article
New insight in the structural features of haloadaptation in α-amylases from halophilic Archaea following homology modeling strategy: folded and stable conformation maintained through low hydrophobicity and highly negative charged surface.
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- Journal of Computer-Aided Molecular Design, 2014, v. 28, n. 7, p. 721, doi. 10.1007/s10822-014-9754-y
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- Article