Research team

Javier received his B.Sc. in Chemistry from the University of Havana (Cuba) in 2022. He is currently a PhD student at ChimieParistech - PSL University. His research is focused on combining machine learning methods and density functional theory calculations to accelerate the exploration and analysis of chemical reactivity.

Bowen received his M.Sc. in Materials and chemical engineering from Guangxi University (China) in 2023. Since early 2024, he is a PhD student at ChimieParistech - PSL University. His research is focused on building innovative deep learning network architectures for rapid thermodynamic and kinetic screening of reaction pathways in chemical reaction networks.

Inès entered the Ecole des Ponts Paristech in 2021. She then joined PSL's Master of Chemistry in Chemistry and Life Sciences, where she is currently studying in M1, as a double degree with her original engineering school. She is currently doing an internship to explore the use of machine learning to obtain cytotoxicity predictions of metal complexes displaying anti-cancer activity.

Basile is a master student at ENS-PSL, currently finishing up his master’s degree in molecular chemistry. At the moment, he is doing an internship to explore the use of machine learning to predict cytoxicity of metal complexes displaying anti-cancer activity.