Jana Sopkova-de Oliveira Santos

11 papers Journal 11
YearRankTypeTitle / Venue / Authors
2021 J jnl
Cryptic Pockets Repository through Pocket Dynamics Tracking and Metadynamics on Essential Dynamics Space: Applications to Mcl-1.
J. Chem. Inf. Model.
Mohammed Benabderrahmane, Ronan Bureau, Anne Sophie Voisin-Chiret, Jana Sopkova-de Oliveira Santos
2020 J jnl
Insights into Mcl-1 Conformational States and Allosteric Inhibition Mechanism from Molecular Dynamics Simulations, Enhanced Sampling, and Pocket Crosstalk Analysis.
J. Chem. Inf. Model.
Mohammed Benabderrahmane, Ronan Bureau, Anne Sophie Voisin-Chiret, Jana Sopkova-de Oliveira Santos
2017 J jnl
Conformation and Dynamics of Human Urotensin II and Urotensin Related Peptide in Aqueous Solution.
J. Chem. Inf. Model.
Elke Haensele, Nawel Mele, Marija Miljak, Christopher M. Read, David C. Whitley, Lee Banting, Carla Delépée, Jana Sopkova-de Oliveira Santos, Alban Lepailleur, Ronan Bureau, Jonathan W. Essex, Timothy Clark
2017 J jnl
Toward Understanding Mcl-1 Promiscuous and Specific Binding Mode.
J. Chem. Inf. Model.
Jade Fogha, Bogdan Marekha, Marcella De Giorgi, Anne Sophie Voisin-Chiret, Sylvain Rault, Ronan Bureau, Jana Sopkova-de Oliveira Santos
2013 J jnl
Conformation Control of Abiotic α-Helical Foldamers.
J. Chem. Inf. Model.
Serge Perato, Jade Fogha, Muriel Sebban, Anne Sophie Voisin-Chiret, Jana Sopkova-de Oliveira Santos, Hassan Oulyadi, Sylvain Rault
2012 J jnl
Structural Characterizations of Oligopyridyl Foldamers, α-Helix Mimetics.
J. Chem. Inf. Model.
Jana Sopkova-de Oliveira Santos, Anne Sophie Voisin-Chiret, Gregory Burzicki, Laure Sebaoun, Muriel Sebban, Jean-François Lohier, Rémi Legay, Hassan Oulyadi, Ronan Bureau, Sylvain Rault
2010 J jnl
Receptor- and Ligand-Based Study on Novel 2, 2′-Bithienyl Derivatives as Non-Peptidic AANAT Inhibitors.
J. Chem. Inf. Model.
Alban Lepailleur, Stéphane Lemaître, Xiao Feng, Jana Sopkova-de Oliveira Santos, Philippe Delagrange, Jean Boutin, Pierre Renard, Ronan Bureau, Sylvain Rault
2010 J jnl
Virtual Screening Discovery of New Acetylcholinesterase Inhibitors Issued from CERMN Chemical Library.
J. Chem. Inf. Model.
Jana Sopkova-de Oliveira Santos, Aurélien Lesnard, Jean-Hugues Agondanou, Nathalie Dupont, Anne-Marie Godard, Silvia Stiebing, Christophe Rochais, Frédéric Fabis, Patrick Dallemagne, Ronan Bureau, Sylvain Rault
2007 J jnl
Definition of New Pharmacophores for Nonpeptide Antagonists of Human Urotensin-II. Comparison with the 3D-structure of Human Urotensin-II and URP.
J. Chem. Inf. Model.
Elodie Lescot, Jana Sopkova-de Oliveira Santos, Christophe Dubessy, Hassan Oulyadi, Aurélien Lesnard, Hubert Vaudry, Ronan Bureau, Sylvain Rault
2005 J jnl
3D-QSAR and Docking Studies of Selective GSK-3beta Inhibitors. Comparison with a Thieno[2, 3-
J. Chem. Inf. Model.
Elodie Lescot, Ronan Bureau, Jana Sopkova-de Oliveira Santos, Christophe Rochais, Vincent Lisowski, Jean-Charles Lancelot, Sylvain Rault
2001 J jnl
Association of Two 3D QSAR Analyses. Application to the Study of Partial Agonist Serotonin-3 Ligands.
J. Chem. Inf. Comput. Sci.
Ronan Bureau, Cyril Daveu, Isabelle Baglin, Jana Sopkova-de Oliveira Santos, Jean-Charles Lancelot, Sylvain Rault