| Druggable pockets and binding site centric chemical space: a paradigm shift in drug discovery S Pérot, O Sperandio, MA Miteva, AC Camproux, BO Villoutreix Drug discovery today 15 (15-16), 656-667, 2010 | 334 | 2010 |
| FAF-Drugs2: free ADME/tox filtering tool to assist drug discovery and chemical biology projects D Lagorce, O Sperandio, H Galons, MA Miteva, BO Villoutreix BMC bioinformatics 9, 1-9, 2008 | 324 | 2008 |
| FAF-Drugs3: a web server for compound property calculation and chemical library design D Lagorce, O Sperandio, JB Baell, MA Miteva, BO Villoutreix Nucleic acids research 43 (W1), W200-W207, 2015 | 316 | 2015 |
| Rationalizing the chemical space of protein–protein interaction inhibitors O Sperandio, CH Reynès, AC Camproux, BO Villoutreix Drug discovery today 15 (5-6), 220-229, 2010 | 245 | 2010 |
| MTiOpenScreen: a web server for structure-based virtual screening CM Labbé, J Rey, D Lagorce, M Vavruša, J Becot, O Sperandio, ... Nucleic acids research 43 (W1), W448-W454, 2015 | 235 | 2015 |
| New machine learning and physics-based scoring functions for drug discovery IA Guedes, AMS Barreto, D Marinho, E Krempser, MA Kuenemann, ... Scientific reports 11 (1), 3198, 2021 | 200 | 2021 |
| Thermoresponsive complex coacervate‐based underwater adhesive M Dompé, FJ Cedano‐Serrano, O Heckert, N van den Heuvel, ... Advanced Materials 31 (21), 1808179, 2019 | 197 | 2019 |
| Thymoquinone as an anticancer agent: evidence from inhibition of cancer cells viability and invasion in vitro and tumor growth in vivo S Attoub, O Sperandio, H Raza, K Arafat, S Al‐Salam, MA Al Sultan, ... Fundamental & clinical pharmacology 27 (5), 557-569, 2013 | 195 | 2013 |
| Designing focused chemical libraries enriched in protein-protein interaction inhibitors using machine-learning methods C Reynès, H Host, AC Camproux, G Laconde, F Leroux, A Mazars, ... PLoS computational biology 6 (3), e1000695, 2010 | 144 | 2010 |
| Free resources to assist structure-based virtual ligand screening experiments BO Villoutreix, N Renault, D Lagorce, O Sperandio, M Montes, MA Miteva Current Protein and Peptide Science 8 (4), 381-411, 2007 | 138 | 2007 |
| Drug‐Like Protein Protein Interaction Modulators: Challenges and Opportunities for Drug Discovery and Chemical Biology BO Villoutreix, MA Kuenemann, JL Poyet, H Bruzzoni‐Giovanelli, ... Molecular informatics 33 (6‐7), 414-437, 2014 | 125 | 2014 |
| iPPI-DB: a manually curated and interactive database of small non-peptide inhibitors of protein–protein interactions CM Labbé, G Laconde, MA Kuenemann, BO Villoutreix, O Sperandio Drug discovery today 18 (19-20), 958-968, 2013 | 120 | 2013 |
| The FAF-Drugs2 server: a multistep engine to prepare electronic chemical compound collections D Lagorce, J Maupetit, J Baell, O Sperandio, P Tufféry, MA Miteva, ... Bioinformatics 27 (14), 2018-2020, 2011 | 109 | 2011 |
| In silico-in vitro screening of protein-protein interactions: towards the next generation of therapeutics BO Villoutreix, K Bastard, O Sperandio, R Fahraeus, JL Poyet, F Calvo, ... Current Pharmaceutical Biotechnology 9 (2), 103-122, 2008 | 88 | 2008 |
| One hundred thousand mouse clicks down the road: selected online resources supporting drug discovery collected over a decade BO Villoutreix, D Lagorce, CM Labbe, O Sperandio, MA Miteva Drug Discovery Today 18 (21-22), 1081-1089, 2013 | 85 | 2013 |
| A leap into the chemical space of protein-protein interaction inhibitors B O Villoutreix, C M Labbe, D Lagorce, G Laconde, O Sperandio Current pharmaceutical design 18 (30), 4648-4667, 2012 | 84 | 2012 |
| How to choose relevant multiple receptor conformations for virtual screening: a test case of Cdk2 and normal mode analysis O Sperandio, L Mouawad, E Pinto, BO Villoutreix, D Perahia, MA Miteva European Biophysics Journal 39, 1365-1372, 2010 | 82 | 2010 |
| Ligand Efficiency Driven Design of New Inhibitors of Mycobacterium tuberculosis Transcriptional Repressor EthR Using Fragment Growing, Merging, and Linking … B Villemagne, M Flipo, N Blondiaux, C Crauste, S Malaquin, F Leroux, ... Journal of medicinal chemistry 57 (11), 4876-4888, 2014 | 79 | 2014 |
| iPPI-DB: an online database of modulators of protein–protein interactions CM Labbé, MA Kuenemann, B Zarzycka, G Vriend, GAF Nicolaes, ... Nucleic acids research 44 (D1), D542-D547, 2016 | 66 | 2016 |
| Receptor-based computational screening of compound databases: the main docking-scoring engines O Sperandio, MA Miteva, F Delfaud, BO Villoutreix Current Protein and Peptide Science 7 (5), 369-393, 2006 | 65 | 2006 |
Bruno VilloutreixInsermVerified email at inserm.fr