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Journal of Cheminformatics|November 1, 2017
Efficient conformational sampling and weak scoring in docking programs? Strategy of the wisdom of crowdsLudovic Chaput, Liliane MouawadBriefings in Bioinformatics|March 19, 2020
Virtual screening web servers: designing chemical probes and drug candidates in the cyberspaceNatesh Singh, Ludovic Chaput, Bruno O VilloutreixJournal of Chemical Information and Modeling|August 14, 2020
Fast Rescoring Protocols to Improve the Performance of Structure-Based Virtual Screening Performed on Protein-Protein InterfacesNatesh Singh, Ludovic Chaput, Bruno O VilloutreixBiotechnology Journal|November 9, 2010
Lipase hydration state in the gas phase: sorption isotherm measurements and inverse gas chromatographyZsuzsanna Marton, Ludovic Chaput, Guillaume Pierre, et al.Journal of Computer-Aided Molecular Design|September 13, 2018
Blinded evaluation of cathepsin S inhibitors from the D3RGC3 dataset using molecular docking and free energy calculationsLudovic Chaput, Edithe Selwa, Eddy Elisée, et al.Journal of Cheminformatics|November 3, 2016
Benchmark of four popular virtual screening programs: construction of the active/decoy dataset remains a major determinant of measured performanceLudovic Chaput, Juan Martinez-Sanz, Nicolas Saettel, et al.Bioinformatics (Oxford, England)|May 14, 2020
FastTargetPred: a program enabling the fast prediction of putative protein targets for input chemical databasesLudovic Chaput, Valentin Guillaume, Natesh Singh, et al.Journal of Cheminformatics|January 26, 2016
vSDC: a method to improve early recognition in virtual screening when limited experimental resources are availableLudovic Chaput, Juan Martinez-Sanz, Eric Quiniou, et al.Molecular Informatics|February 7, 2019
Identification of New Potent Acetylcholinesterase Inhibitors Using Virtual Screening and in vitro ApproachesEl Hassen Mokrani, Abderrahmane Bensegueni, Ludovic Chaput, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|June 8, 2018
Topology-Selective, Fluorescent "Light-Up" Probes for G-Quadruplex DNA Based on Photoinduced Electron TransferXiao Xie, Oksana Reznichenko, Ludovic Chaput, et al.Pageof 2