Jana Sopkova-de Oliveira Santos

According to our database, Jana Sopkova-de Oliveira Santos authored at least 11 papers between 2001 and 2021.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2021

Cryptic Pockets Repository through Pocket Dynamics Tracking and Metadynamics on Essential Dynamics Space: Applications to Mcl-1.

Mohammed Benabderrahmane, Ronan Bureau, Anne Sophie Voisin-Chiret, Jana Sopkova-de Oliveira Santos

J. Chem. Inf. Model., 2021

2020

Insights into Mcl-1 Conformational States and Allosteric Inhibition Mechanism from Molecular Dynamics Simulations, Enhanced Sampling, and Pocket Crosstalk Analysis.

Mohammed Benabderrahmane, Ronan Bureau, Anne Sophie Voisin-Chiret, Jana Sopkova-de Oliveira Santos

J. Chem. Inf. Model., 2020

2017

Toward Understanding Mcl-1 Promiscuous and Specific Binding Mode.

Jade Fogha, Bogdan Marekha, Marcella De Giorgi, Anne Sophie Voisin-Chiret, Sylvain Rault, Ronan Bureau, Jana Sopkova-de Oliveira Santos

J. Chem. Inf. Model., November, 2017

Conformation and Dynamics of Human Urotensin II and Urotensin Related Peptide in Aqueous Solution.

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

J. Chem. Inf. Model., 2017

2013

Conformation Control of Abiotic α-Helical Foldamers.

Serge Perato, Jade Fogha, Muriel Sebban, Anne Sophie Voisin-Chiret, Jana Sopkova-de Oliveira Santos, Hassan Oulyadi, Sylvain Rault

J. Chem. Inf. Model., 2013

2012

Structural Characterizations of Oligopyridyl Foldamers, α-Helix Mimetics.

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

J. Chem. Inf. Model., 2012

2010

Virtual Screening Discovery of New Acetylcholinesterase Inhibitors Issued from CERMN Chemical Library.

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

J. Chem. Inf. Model., 2010

Receptor- and Ligand-Based Study on Novel 2, 2′-Bithienyl Derivatives as Non-Peptidic AANAT Inhibitors.

Alban Lepailleur, Stéphane Lemaître, Xiao Feng, Jana Sopkova-de Oliveira Santos, Philippe Delagrange, Jean Boutin, Pierre Renard, Ronan Bureau, Sylvain Rault

J. Chem. Inf. Model., 2010

2007

Definition of New Pharmacophores for Nonpeptide Antagonists of Human Urotensin-II. Comparison with the 3D-structure of Human Urotensin-II and URP.

Elodie Lescot, Jana Sopkova-de Oliveira Santos, Christophe Dubessy, Hassan Oulyadi, Aurélien Lesnard, Hubert Vaudry, Ronan Bureau, Sylvain Rault

J. Chem. Inf. Model., 2007

2005

3D-QSAR and Docking Studies of Selective GSK-3beta Inhibitors. Comparison with a Thieno[2, 3-<i>b</i>]pyrrolizinone Derivative, a New Potential Lead for GSK-3beta Ligands.

Elodie Lescot, Ronan Bureau, Jana Sopkova-de Oliveira Santos, Christophe Rochais, Vincent Lisowski, Jean-Charles Lancelot, Sylvain Rault

J. Chem. Inf. Model., 2005

2001

Association of Two 3D QSAR Analyses. Application to the Study of Partial Agonist Serotonin-3 Ligands.

Ronan Bureau, Cyril Daveu, Isabelle Baglin, Jana Sopkova-de Oliveira Santos, Jean-Charles Lancelot, Sylvain Rault

J. Chem. Inf. Comput. Sci., 2001