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  • Publication
  • Sep 8, 2015
Macrocycle Conformational Sampling with MacroModel
Watts, et al. J. Chem. Inf. Model., 2014, 54(10), 2680-2696
  • Publication
  • Sep 8, 2015
Mixed ab initio QM/MM Modeling Using Frozen Orbitals and Tests with Alanine Dipeptide and Tetrapeptide
Philipp, et al. J. Comp. Chem., 1999, 20, 1468-1494
  • Publication
  • Sep 8, 2015
Optimization of CAMD techniques 3. Virtual screening enrichment studies: a help or hindrance to tool selection?
Good, et al. J. Comput. Aided Mol. Des., 2008, 22, 169-178
  • Publication
  • Sep 8, 2015
Exploring Conformational Search Protocols for Ligand-based Virtual Screening and 3-D QSAR Modeling
Cappel, et al. J. Comput. Aided Mol. Des., 2015, 29(2), 165-182
  • Publication
  • Sep 8, 2015
Computational Validation of the Importance of Absolute Stereochemistry in Virtual Screening
Brooks, et al. J. Chem. Inf. Model, 2008, 48, 639-645
  • Publication
  • Sep 8, 2015
Pose prediction accuracy in docking studies and enrichment of actives in the active site of GSK-3′
Gadakar, et al. J. Chem. Inf. Model., 2007, 47, 1446-1459
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