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Journal of Chemical Information and Modeling|September 14, 2010
Training a scoring function for the alignment of small moleculesShek Ling Chan, Paul LabuteJournal of Chemical Information and Modeling|April 28, 2009
Docking ligands into flexible and solvated macromolecules. 3. Impact of input ligand conformation, protein flexibility, and water molecules on the accuracy of docking programsChristopher R Corbeil, Nicolas MoitessierCombinatorial Chemistry & High Throughput Screening|April 23, 2002
A probabilistic approach to high throughput drug discoveryPaul Labute, Shahul Nilar, Christopher WilliamsProteins|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 Chemical Information and Modeling|February 20, 2007
Docking ligands into flexible and solvated macromolecules. 1. Development and validation of FITTED 1.0Christopher R Corbeil, Pablo Englebienne, Nicolas MoitessierBioinformatics (Oxford, England)|March 26, 2025
AI-augmented physics-based docking for antibody-antigen complex predictionFrancis Gaudreault, Traian Sulea, Christopher R CorbeilScientific Reports|September 13, 2023
Enhanced antibody-antigen structure prediction from molecular docking using AlphaFold2Francis Gaudreault, Christopher R Corbeil, Traian SuleaJournal 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 LabuteJournal of Computer-Aided Molecular Design|April 24, 2010
Rapid prediction of solvation free energy. 3. Application to the SAMPL2 challengeEnrico O Purisima, Christopher R Corbeil, Traian SuleaPageof 7