Esther Kellenberger

Affiliations

UMR 7200 CNRS Université de Strasbourg, 67400 Illkirch, France.

ORCID: 0000-0002-9320-4840

Publications (12)

Modeling of CCR5 Recognition by HIV-1 gp120: How the Viral Protein Exploits the Conformational Plasticity of the Coreceptor.

Viruses

Avec: Célien Jacquemard , Florian Koensgen , Philippe Colin , Bernard Lagane , Esther Kellenberger

Structural Insights into Molecular Recognition and Receptor Activation in Chemokine-Chemokine Receptor Complexes.

Journal of medicinal chemistry

Avec: Lauri Urvas , Esther Kellenberger

Structural analysis of neomycin B and kanamycin A binding Aminoglycosides Modifying Enzymes (AME) and bacterial ribosomal RNA.

Molecular informatics

Avec: Julia Revillo Imbernon , Jean-Marc Weibel , Eric Ennifar , Gilles Prévost , Esther Kellenberger

Inhibition of the NAD salvage pathway in schistosomes impairs metabolism, reproduction, and parasite survival.

PLoS pathogens

Avec: Michael D Schultz , Tulin Dadali , Sylvain A Jacques , Hélène Muller-Steffner , Jeremy B Foote , Leonardo Sorci , Esther Kellenberger , Davide Botta , Frances E Lund

Local Interaction Density (LID), a Fast and Efficient Tool to Prioritize Docking Poses.

Molecules (Basel, Switzerland)

Avec: Célien Jacquemard , Viet-Khoa Tran-Nguyen , Malgorzata N Drwal , Didier Rognan , Esther Kellenberger

Binding mode information improves fragment docking.

Journal of cheminformatics

Avec: Célien Jacquemard , Malgorzata N Drwal , Jérémy Desaphy , Esther Kellenberger

Predicting the duration of action of β2-adrenergic receptor agonists: Ligand and structure-based approaches.

Molecular informatics

Avec: Luca Chiesa , Emilie Sick , Esther Kellenberger

Benchmarking AlphaFold-Generated Structures of Chemokine-Chemokine Receptor Complexes.

Journal of chemical information and modeling

Avec: Lauri Urvas , Luca Chiesa , Guillaume Bret , Célien Jacquemard , Esther Kellenberger

Is it time for artificial intelligence to predict the function of natural products based on 2D-structure.

MedChemComm

Avec: Miaomiao Liu , Peter Karuso , Yunjiang Feng , Esther Kellenberger , Fei Liu , Can Wang , Ronald J Quinn

Comparing transmembrane protein structures with ATOLL.

Bioinformatics (Oxford, England)

Avec: Célien Jacquemard , Guillaume Bret , Thomas Grutter , Esther Kellenberger

Comprehensive analysis of commercial fragment libraries.

RSC medicinal chemistry

Avec: Julia Revillo Imbernon , Célien Jacquemard , Guillaume Bret , Gilles Marcou , Esther Kellenberger

Unsupervised Classification of G-Protein Coupled Receptors and Their Conformational States Using IChem Intramolecular Interaction Patterns.

Journal of chemical information and modeling

Avec: Florian Koensgen , Franck Da Silva , Didier Rognan , Esther Kellenberger

Réseau de co-auteurs

Célien Jacquemard 6 collaborations

Guillaume Bret 3 collaborations

Florian Koensgen 2 collaborations

Lauri Urvas 2 collaborations

Julia Revillo Imbernon 2 collaborations

Malgorzata N Drwal 2 collaborations

Didier Rognan 2 collaborations

Luca Chiesa 2 collaborations

Philippe Colin 1 collaboration

Bernard Lagane 1 collaboration

Jean-Marc Weibel 1 collaboration

Eric Ennifar 1 collaboration

Gilles Prévost 1 collaboration

Michael D Schultz 1 collaboration

Tulin Dadali 1 collaboration

Sylvain A Jacques 1 collaboration

Hélène Muller-Steffner 1 collaboration

Jeremy B Foote 1 collaboration

Leonardo Sorci 1 collaboration

Davide Botta 1 collaboration

Frances E Lund 1 collaboration

Viet-Khoa Tran-Nguyen 1 collaboration

Jérémy Desaphy 1 collaboration

Emilie Sick 1 collaboration

Miaomiao Liu 1 collaboration

Peter Karuso 1 collaboration

Yunjiang Feng 1 collaboration

Fei Liu 1 collaboration

Can Wang 1 collaboration

Ronald J Quinn 1 collaboration

Thomas Grutter 1 collaboration

Gilles Marcou 1 collaboration

Franck Da Silva 1 collaboration