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ORCIDJana Sopkova-de Oliveira Santos
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Journal Articles
- 2021
[j11]Mohammed Benabderrahmane, Ronan Bureau
, Anne Sophie Voisin-Chiret, Jana Sopkova-de Oliveira Santos:
Cryptic Pockets Repository through Pocket Dynamics Tracking and Metadynamics on Essential Dynamics Space: Applications to Mcl-1. J. Chem. Inf. Model. 61(11): 5581-5588 (2021)- 2020
- [j10]Mohammed Benabderrahmane, Ronan Bureau, Anne Sophie Voisin-Chiret, Jana Sopkova-de Oliveira Santos:
Insights into Mcl-1 Conformational States and Allosteric Inhibition Mechanism from Molecular Dynamics Simulations, Enhanced Sampling, and Pocket Crosstalk Analysis. J. Chem. Inf. Model. 60(6): 3172-3187 (2020) - 2017
- [j9]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:
Conformation and Dynamics of Human Urotensin II and Urotensin Related Peptide in Aqueous Solution. J. Chem. Inf. Model. 57(2): 298-310 (2017) - [j8]Jade Fogha, Bogdan Marekha, Marcella De Giorgi, Anne Sophie Voisin-Chiret, Sylvain Rault, Ronan Bureau, Jana Sopkova-de Oliveira Santos:
Toward Understanding Mcl-1 Promiscuous and Specific Binding Mode. J. Chem. Inf. Model. 57(11): 2885-2895 (2017) - 2013
- [j7]Serge Perato, Jade Fogha, Muriel Sebban, Anne Sophie Voisin-Chiret, Jana Sopkova-de Oliveira Santos, Hassan Oulyadi, Sylvain Rault:
Conformation Control of Abiotic α-Helical Foldamers. J. Chem. Inf. Model. 53(10): 2671-2680 (2013) - 2012
- [j6]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:
Structural Characterizations of Oligopyridyl Foldamers, α-Helix Mimetics. J. Chem. Inf. Model. 52(2): 429-439 (2012) - 2010
- [j5]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:
Virtual Screening Discovery of New Acetylcholinesterase Inhibitors Issued from CERMN Chemical Library. J. Chem. Inf. Model. 50(3): 422-428 (2010) - [j4]Alban Lepailleur, Stéphane Lemaître, Xiao Feng, Jana Sopkova-de Oliveira Santos, Philippe Delagrange, Jean Boutin, Pierre Renard, Ronan Bureau, Sylvain Rault:
Receptor- and Ligand-Based Study on Novel 2, 2′-Bithienyl Derivatives as Non-Peptidic AANAT Inhibitors. J. Chem. Inf. Model. 50(3): 446-460 (2010) - 2007
- [j3]Elodie Lescot, Jana Sopkova-de Oliveira Santos, Christophe Dubessy, Hassan Oulyadi, Aurélien Lesnard, Hubert Vaudry, Ronan Bureau, Sylvain Rault:
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. 47(2): 602-612 (2007) - 2005
- [j2]Elodie Lescot, Ronan Bureau, Jana Sopkova-de Oliveira Santos, Christophe Rochais, Vincent Lisowski, Jean-Charles Lancelot, Sylvain Rault:
3D-QSAR and Docking Studies of Selective GSK-3beta Inhibitors. Comparison with a Thieno[2, 3-b]pyrrolizinone Derivative, a New Potential Lead for GSK-3beta Ligands. J. Chem. Inf. Model. 45(3): 708-715 (2005) - 2001
- [j1]Ronan Bureau, Cyril Daveu, Isabelle Baglin, Jana Sopkova-de Oliveira Santos, Jean-Charles Lancelot, Sylvain Rault:
Association of Two 3D QSAR Analyses. Application to the Study of Partial Agonist Serotonin-3 Ligands. J. Chem. Inf. Comput. Sci. 41(3): 815-823 (2001)
Coauthor Index
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