last update : 22/06/2021

Manon Réau, PhD in chemoinformatics [read more]

Application Scientist, Qubit Pharmaceuticals, Paris, France

Main focus

Most of my work consists in studying molecular interactions through the prism of structural bioinformatics tools to 1) understand biological phenomenon, 2) identify hits for therapeutic research, 3) predict unwanted effects of either drugs or contaminants.

I focused my PhD research (@ Le cnam - GBCM ) on the study of the importance of considering inactive data provided by experimentalist to evaluate the performance of in silico models. See more details here.

I recently worked on the development of new tools to study small molecule/ protein interactions and protein-protein interactions :

• P.I. Koukos, M.F. Reau and A.M.J.J. Bonvin. Shape-restrained modelling of protein-small molecule complexes with HADDOCK. bioRxiv doi:10.1101/2021.06.10.447890 (2021).
• Deeprank-GNN : A Graph Neural Network Framework to Learn Interaction Patterns from Protein-Protein Interfaces

Last news

• 03/22 : I am delighted to join Qubit Pharmaceuticals as an application scientist !
• 06/21 : Happy to share our new shape-restrained protein-ligand HADDOCK docking protocol : Shape-restrained modelling of protein-small molecule complexes with HADDOCK. Congrats to Dr P.Koukos for the brilliant team work !
• 03/20 : HADDDOCK COVID drug repurposing against SARS-CoV-2 targets : https://www.bonvinlab.org/covid/
• 02/20 : A new adventure begins with the Bonvin Lab in Utrecht !
• 12/19 : Last month with the wonderful GBCM team - Cnam and all my brilliant colleagues & friends there.
• 10/19 : Defense-DAY, with golden colleagues/friends/family ! - Le cnam - GBCM