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Journal of Chemical Information and Modeling|August 10, 2010
Pocket similarity: are alpha carbons enough?Howard J Feldman, Paul LabuteJournal of Chemical Information and Modeling|September 14, 2010
Training a scoring function for the alignment of small moleculesShek Ling Chan, Paul LabuteAdvances in Experimental Medicine and Biology|May 31, 2018
Discovery of Potent Non-nucleoside Inhibitors of Dengue Viral RNA-Dependent RNA Polymerase from Fragment Screening and Structure-Guided DesignSiew Pheng Lim, Christian G Noble, Shahul Nilar, et al.Proteins|April 10, 2014
Assessment of fully automated antibody homology modeling protocols in molecular operating environmentJohannes K X Maier, Paul LabuteJournal of Chemical Information and Modeling|May 23, 2006
2D structure depictionAlex M Clark, Paul Labute, Martin SantavyJournal of Computer-Aided Molecular Design|May 9, 2012
Variability in docking success rates due to dataset preparationChristopher R Corbeil, Christopher I Williams, Paul LabuteJournal of Chemical Theory and Computation|March 18, 2014
A Cavity Corrected 3D-RISM Functional for Accurate Solvation Free EnergiesJean-François Truchon, B Montgomery Pettitt, Paul LabuteAngewandte Chemie (International Ed. in English)|September 30, 2015
Understanding P450-mediated Bio-transformations into Epoxide and Phenolic MetabolitesAnna Tomberg, Joshua Pottel, Zhaomin Liu, et al.Mabs|October 11, 2021
Structure-based charge calculations for predicting isoelectric point, viscosity, clearance, and profiling antibody therapeuticsNels Thorsteinson, John R Gunn, Kenneth Kelly, et al.Journal of Chemical Information and Modeling|December 19, 2017
Atom Types Independent Molecular Mechanics Method for Predicting the Conformational Energy of Small MoleculesZhaomin Liu, Stephen J Barigye, Moeed Shahamat, et al.Pageof 38