Célien Jacquemard

Do Fragments and Crystallization Additives Bind Similarly to Drug-like Ligands?

Carlos Perez, Esther Kellenberger, Malgorzata N. Drwal, 2017, J. Chem. Inf. Model..

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

Didier Rognan, Esther Kellenberger, Célien Jacquemard, 2019, Molecules.

LIT-PCBA: An Unbiased Data Set for Machine Learning and Virtual Screening

Didier Rognan, Célien Jacquemard, Viet-Khoa Tran-Nguyen, 2020, J. Chem. Inf. Model..

Binding mode information improves fragment docking

Esther Kellenberger, Malgorzata N. Drwal, Célien Jacquemard, 2019, Journal of Cheminformatics.

A bright future for fragment-based drug discovery: what does it hold?

Esther Kellenberger, Célien Jacquemard, E. Kellenberger, 2019, Expert opinion on drug discovery.

Structural Insights on Fragment Binding Mode Conservation.

Guillaume Bret, Esther Kellenberger, Malgorzata N. Drwal, 2018, Journal of medicinal chemistry.