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Journal of Chemical Information and Modeling|August 7, 2023
Comparative Performance of High-Throughput Methods for Protein pKa PredictionsWanlei Wei, Hervé Hogues, Traian SuleaJournal of Chemical Information and Modeling|August 19, 2015
Evaluation of the Wilma-SIE Virtual Screening Method in Community Structure-Activity Resource 2013 and 2014 Blind ChallengesHervé Hogues, Traian Sulea, Enrico O PurisimaBiological Chemistry|August 18, 2006
Structural aspects of recently discovered viral deubiquitinating activitiesTraian Sulea, Holger A Lindner, Robert MénardJournal of Computational Chemistry|September 22, 2006
Coupled atomic charge selectivity for optimal ligand-charge distributions at protein binding sitesSathesh Bhat, Traian Sulea, Enrico O PurisimaJournal of Chemical Information and Modeling|July 1, 2011
Solvated interaction energy (SIE) for scoring protein-ligand binding affinities. 2. Benchmark in the CSAR-2010 scoring exerciseTraian Sulea, Qizhi Cui, Enrico O PurisimaJournal of Computer-Aided Molecular Design|December 27, 2011
Exhaustive search and solvated interaction energy (SIE) for virtual screening and affinity predictionTraian Sulea, Hervé Hogues, Enrico O PurisimaScientific Reports|September 13, 2023
Enhanced antibody-antigen structure prediction from molecular docking using AlphaFold2Francis Gaudreault, Christopher R Corbeil, Traian SuleaBioinformatics (Oxford, England)|March 26, 2025
AI-augmented physics-based docking for antibody-antigen complex predictionFrancis Gaudreault, Traian Sulea, Christopher R CorbeilJournal of Computer-Aided Molecular Design|January 30, 2014
Exhaustive docking and solvated interaction energy scoring: lessons learned from the SAMPL4 challengeHervé Hogues, Traian Sulea, Enrico O PurisimaJournal 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 11