Esther Kellenberger

13 papers Journal 13
YearRankTypeTitle / Venue / Authors
2025 J jnl
Modeling Active-State Conformations of G-Protein-Coupled Receptors Using AlphaFold2 via Template Bias and Explicit Protein Constrains.
J. Chem. Inf. Model.
Luca Chiesa, Dina Khasanova, Esther Kellenberger
2024 J jnl
Benchmarking AlphaFold-Generated Structures of Chemokine-Chemokine Receptor Complexes.
J. Chem. Inf. Model.
Lauri Urvas, Luca Chiesa, Guillaume Bret, Célien Jacquemard, Esther Kellenberger
2022 J jnl
Comparing transmembrane protein structures with ATOLL.
Bioinform.
Célien Jacquemard, Guillaume Bret, Thomas Grutter, Esther Kellenberger
2022 J jnl
One class classification for the detection of β2 adrenergic receptor agonists using single-ligand dynamic interaction data.
J. Cheminformatics
Luca Chiesa, Esther Kellenberger
2019 J jnl
Binding mode information improves fragment docking.
J. Cheminformatics
Célien Jacquemard, Malgorzata N. Drwal, Jérémy Desaphy, Esther Kellenberger
2019 J jnl
Unsupervised Classification of G-Protein Coupled Receptors and Their Conformational States Using IChem Intramolecular Interaction Patterns.
J. Chem. Inf. Model.
Florian Koensgen, Franck Da Silva, Didier Rognan, Esther Kellenberger
2017 J jnl
Do Fragments and Crystallization Additives Bind Similarly to Drug-like Ligands?
J. Chem. Inf. Model.
Malgorzata N. Drwal, Célien Jacquemard, Carlos Perez, Jérémy Desaphy, Esther Kellenberger
2015 J jnl
sc-PDB: a 3D-database of ligandable binding sites - 10 years on.
Nucleic Acids Res.
Jérémy Desaphy, Guillaume Bret, Didier Rognan, Esther Kellenberger
2012 J jnl
Comparison and Druggability Prediction of Protein-Ligand Binding Sites from Pharmacophore-Annotated Cavity Shapes.
J. Chem. Inf. Model.
Jérémy Desaphy, Karima Azdimousa, Esther Kellenberger, Didier Rognan
2012 J jnl
Structural Insights into the Molecular Basis of the Ligand Promiscuity.
J. Chem. Inf. Model.
Noé Sturm, Jérémy Desaphy, Ronald J. Quinn, Didier Rognan, Esther Kellenberger
2011 J jnl
sc-PDB: a database for identifying variations and multiplicity of 'druggable' binding sites in proteins.
Bioinform.
Jamel Meslamani, Didier Rognan, Esther Kellenberger
2008 J jnl
Ranking Targets in Structure-Based Virtual Screening of Three-Dimensional Protein Libraries: Methods and Problems.
J. Chem. Inf. Model.
Esther Kellenberger, Nicolas Foata, Didier Rognan
2006 J jnl
sc-PDB: an Annotated Database of Druggable Binding Sites from the Protein Data Bank.
J. Chem. Inf. Model.
Esther Kellenberger, Pascal Muller, Claire Schalon, Guillaume Bret, Nicolas Foata, Didier Rognan