MS-DOCK: Accurate multiple conformation generator and rigid docking protocol for multi-step virtual ligand screening

Por Sauton, Nicolas, Lagorce, David, Villoutreix, Bruno O, Miteva, Maria A
Publicado em 2008

DG-AMMOS: A New tool to generate 3D conformation of small molecules using Distance Geometry and Automated Molecular Mechanics Optimization for in silico Screening

Por Lagorce, David, Pencheva, Tania, Villoutreix, Bruno O, Miteva, Maria A
Publicado em 2009

Computational analysis of calculated physicochemical and ADMET properties of protein-protein interaction inhibitors

Por Lagorce, David, Douguet, Dominique, Miteva, Maria A., Villoutreix, Bruno O.
Publicado no Sci Rep (2017)

A leap into the chemical space of protein-protein interaction inhibitors

Por Villoutreix, Bruno O., Labbé, Céline, Lagorce, David, Laconde, Guillaume, Sperandio, Olivier
Publicado em 2012

FAF-Drugs2: Free ADME/tox filtering tool to assist drug discovery and chemical biology projects

Por Lagorce, David, Sperandio, Olivier, Galons, Hervé, Miteva, Maria A, Villoutreix, Bruno O
Publicado em 2008

AMMOS: Automated Molecular Mechanics Optimization tool for in silico Screening

Por Pencheva, Tania, Lagorce, David, Pajeva, Ilza, Villoutreix, Bruno O, Miteva, Maria A
Publicado em 2008

Rational Design of Small-Molecule Stabilizers of Spermine Synthase Dimer by Virtual Screening and Free Energy-Based Approach

Por Zhang, Zhe, Martiny, Virginie, Lagorce, David, Ikeguchi, Yoshihiko, Alexov, Emil, Miteva, Maria A.
Publicado em 2014

FAF-Drugs3: a web server for compound property calculation and chemical library design

Por Lagorce, David, Sperandio, Olivier, Baell, Jonathan B., Miteva, Maria A., Villoutreix, Bruno O.
Publicado no Nucleic Acids Res (2015)

Tyrosine Kinase Syk Non-Enzymatic Inhibitors and Potential Anti-Allergic Drug-Like Compounds Discovered by Virtual and In Vitro Screening

Por Villoutreix, Bruno O., Laconde, Guillaume, Lagorce, David, Martineau, Pierre, Miteva, Maria A., Dariavach, Piona
Publicado em 2011

In Silico Mechanistic Profiling to Probe Small Molecule Binding to Sulfotransferases

Por Martiny, Virginie Y., Carbonell, Pablo, Lagorce, David, Villoutreix, Bruno O., Moroy, Gautier, Miteva, Maria A.
Publicado em 2013

Identification and functional characterization of a new member of the human Mcm protein family: hMcm8

Por Gozuacik, Devrim, Chami, Mounia, Lagorce, David, Faivre, Jamila, Murakami, Yoshiki, Poch, Olivier, Biermann, Esther, Knippers, Rolf, Bréchot, Christian, Paterlini-Bréchot, Patrizia
Publicado em 2003

Drug-Like Protein–Protein Interaction Modulators: Challenges and Opportunities for Drug Discovery and Chemical Biology

Por Villoutreix, Bruno O, Kuenemann, Melaine A, Poyet, Jean-Luc, Bruzzoni-Giovanelli, Heriberto, Labbé, Céline, Lagorce, David, Sperandio, Olivier, Miteva, Maria A
Publicado em 2014

MTiOpenScreen: a web server for structure-based virtual screening

Por Labbé, Céline M., Rey, Julien, Lagorce, David, Vavruša, Marek, Becot, Jérome, Sperandio, Olivier, Villoutreix, Bruno O., Tufféry, Pierre, Miteva, Maria A.
Publicado no Nucleic Acids Res (2015)

In silico model of the human ClC-Kb chloride channel: pore mapping, biostructural pathology and drug screening

Por Louet, Maxime, Bitam, Sara, Bakouh, Naziha, Bignon, Yohan, Planelles, Gabrielle, Lagorce, David, Miteva, Maria A., Eladari, Dominique, Teulon, Jacques, Villoutreix, Bruno O.
Publicado no Sci Rep (2017)

iPPI-DB: an online database of modulators of protein–protein interactions

Por Labbé, Céline M., Kuenemann, Mélaine A., Zarzycka, Barbara, Vriend, Gert, Nicolaes, Gerry A.F., Lagorce, David, Miteva, Maria A., Villoutreix, Bruno O., Sperandio, Olivier
Publicado no Nucleic Acids Res (2016)

Serca1 Truncated Proteins Unable to Pump Calcium Reduce the Endoplasmic Reticulum Calcium Concentration and Induce Apoptosis

Por Chami, Mounia, Gozuacik, Devrim, Lagorce, David, Brini, Marisa, Falson, Pierre, Peaucellier, Gérard, Pinton, Paolo, Lecoeur, Hervé, Gougeon, Marie-Lyse, le Maire, Marc, Rizzuto, Rosario, Bréchot, Christian, Paterlini-Bréchot, Patrizia
Publicado em 2001

Fr-PPIChem: An Academic Compound Library Dedicated to Protein-Protein Interactions

Por Bosc, Nicolas, Muller, Christophe, Hoffer, Laurent, Lagorce, David, Bourg, Stéphane, Derviaux, Carine, Gourdel, Marie-Edith, Rain, Jean-Christophe, Miller, Thomas W., Villoutreix, Bruno O., Miteva, Maria A., Bonnet, Pascal, Morelli, Xavier, Sperandio, Olivier, Roche, Philippe
Publicado no ACS Chem Biol (2020)

The Human Phenotype Ontology in 2021

Por Köhler, Sebastian, Gargano, Michael, Matentzoglu, Nicolas, Carmody, Leigh C, Lewis-Smith, David, Vasilevsky, Nicole A, Danis, Daniel, Balagura, Ganna, Baynam, Gareth, Brower, Amy M, Callahan, Tiffany J, Chute, Christopher G, Est, Johanna L, Galer, Peter D, Ganesan, Shiva, Griese, Matthias, Haimel, Matthias, Pazmandi, Julia, Hanauer, Marc, Harris, Nomi L, Hartnett, Michael J, Hastreiter, Maximilian, Hauck, Fabian, He, Yongqun, Jeske, Tim, Kearney, Hugh, Kindle, Gerhard, Klein, Christoph, Knoflach, Katrin, Krause, Roland, Lagorce, David, McMurry, Julie A, Miller, Jillian A, Munoz-Torres, Monica C, Peters, Rebecca L, Rapp, Christina K, Rath, Ana M, Rind, Shahmir A, Rosenberg, Avi Z, Segal, Michael M, Seidel, Markus G, Smedley, Damian, Talmy, Tomer, Thomas, Yarlalu, Wiafe, Samuel A, Xian, Julie, Yüksel, Zafer, Helbig, Ingo, Mungall, Christopher J, Haendel, Melissa A, Robinson, Peter N
Publicado no Nucleic Acids Res (2020)