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  • Publication
  • Sep 8, 2015
New Linear Interaction Method for Binding Affinity Calculations Using a Continuum Solvent Model
Zhou, et al. J. Phys. Chem. B, 2001, 105, 10388-10397
  • Publication
  • Sep 8, 2015
Structure-guided discovery of cyclin-dependent kinase inhibitors
Fischmann, et al. Biopolymers, 2008, 89, 372-379
  • Publication
  • Sep 8, 2015
Intermediates in dioxygen activation by methane monooxygenase: a QM/MM study
Rinaldo, et al. J. Am. Chem. Soc., 2007, 129, 3135-3147
  • Publication
  • Sep 8, 2015
Structure-based approach to the prediction of disulfide bonds in proteins
Salam, et al. Protein Eng. Des. Sel., 2014, 27(10), 365-74
  • Publication
  • Sep 8, 2015
Docking covalent inhibitors: A parameter free approach to pose prediction and scoring
Zhu, et al. J. Chem. Inf. Model., 2014, 54, 1932-1940
  • Publication
  • Sep 8, 2015
Ab initio structure prediction of the antibody hypervariable H3 loop
Zhu, et al. Proteins, 2013, 81(6), 1081-1089
  • Publication
  • Sep 8, 2015
Dioxygen Activation in Methane Monooxygenase: A Theoretical Study
Gherman, et al. J. Am. Chem. Soc., 2004, 126, 2978-2990
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