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Journal of Computer-Aided Molecular Design|January 25, 2014
Virtual screening of the SAMPL4 blinded HIV integrase inhibitors datasetClaire Colas, Bogdan I IorgaJournal of Computer-Aided Molecular Design|December 20, 2011
Evaluation of docking performance in a blinded virtual screening of fragment-like trypsin inhibitorsGeorgiana Surpateanu, Bogdan I IorgaJournal of Computer-Aided Molecular Design|December 22, 2011
Prediction of hydration free energies for aliphatic and aromatic chloro derivatives using molecular dynamics simulations with the OPLS-AA force fieldOliver Beckstein, Bogdan I IorgaBioinformatics (Oxford, England)|January 29, 2017
Ligandbook: an online repository for small and drug-like molecule force field parametersJan Domanski, Oliver Beckstein, Bogdan I IorgaExpert Opinion on Therapeutic Patents|September 22, 2023
An updated patent review of metallo-β-lactamase inhibitors (2020-2023)Elsa Denakpo, Thierry Naas, Bogdan I IorgaCurrent Drug Targets|March 11, 2016
Structural and Functional Aspects of Class A CarbapenemasesThierry Naas, Laurent Dortet, Bogdan I IorgaJournal of Computer-Aided Molecular Design|January 22, 2020
Prediction of octanol-water partition coefficients for the SAMPL6-<math>
</math> molecules using molecular dynamics simulations with OPLS-AA, AMBER and CHARMM force fieldsShujie Fan, Bogdan I Iorga, Oliver BecksteinEuropean Journal of Medicinal Chemistry|March 26, 2011
New potent human acetylcholinesterase inhibitors in the tetracyclic triterpene series with inhibitory potency on amyloid β aggregationJulien Rouleau, Bogdan I Iorga, Catherine GuillouJournal of Computer-Aided Molecular Design|February 22, 2014
Prediction of hydration free energies for the SAMPL4 diverse set of compounds using molecular dynamics simulations with the OPLS-AA force fieldOliver Beckstein, Anaïs Fourrier, Bogdan I IorgaJournal of Computer-Aided Molecular Design|October 5, 2016
Molecular docking performance evaluated on the D3R Grand Challenge 2015 drug-like ligand datasetsEdithe Selwa, Virginie Y Martiny, Bogdan I IorgaPageof 10