Tony Lelièvre

Affiliations

CERMICS, Ecole des Ponts, Marne-la-Vallée, France.
Matherials Project-Team, Inria Paris, 75012 Paris, France.

Publications (6)

Machine Learning Force Fields and Coarse-Grained Variables in Molecular Dynamics: Application to Materials and Biological Systems.

Journal of chemical theory and computation

Avec: Paraskevi Gkeka , Gabriel Stoltz , Amir Barati Farimani , Zineb Belkacemi , Michele Ceriotti , John D Chodera , Aaron R Dinner , Andrew L Ferguson , Jean-Bernard Maillet , Hervé Minoux , Christine Peter , Fabio Pietrucci , Ana Silveira , Alexandre Tkatchenko , Zofia Trstanova , Rafal Wiewiora , Tony Lelièvre

Computing Surface Reaction Rates by Adaptive Multilevel Splitting Combined with Machine Learning and

Journal of chemical theory and computation

Avec: Thomas Pigeon , Gabriel Stoltz , Manuel Corral-Valero , Ani Anciaux-Sedrakian , Maxime Moreaud , Tony Lelièvre , Pascal Raybaud

Analyzing Multimodal Probability Measures with Autoencoders.

The journal of physical chemistry. B

Avec: Tony Lelièvre , Thomas Pigeon , Gabriel Stoltz , Wei Zhang

Local and global perspectives on diffusion maps in the analysis of molecular systems.

Proceedings. Mathematical, physical, and engineering sciences

Avec: Z Trstanova , B Leimkuhler , T Lelièvre

Chasing Collective Variables Using Autoencoders and Biased Trajectories.

Journal of chemical theory and computation

Avec: Zineb Belkacemi , Paraskevi Gkeka , Tony Lelièvre , Gabriel Stoltz

On a new class of score functions to estimate tail probabilities of some stochastic processes with adaptive multilevel splitting.

Chaos (Woodbury, N.Y.)

Avec: Charles-Edouard Bréhier , Tony Lelièvre

Réseau de co-auteurs

Gabriel Stoltz 4 collaborations

Paraskevi Gkeka 2 collaborations

Zineb Belkacemi 2 collaborations

Thomas Pigeon 2 collaborations

Amir Barati Farimani 1 collaboration

Michele Ceriotti 1 collaboration

John D Chodera 1 collaboration

Aaron R Dinner 1 collaboration

Andrew L Ferguson 1 collaboration

Jean-Bernard Maillet 1 collaboration

Hervé Minoux 1 collaboration

Christine Peter 1 collaboration

Fabio Pietrucci 1 collaboration

Ana Silveira 1 collaboration

Alexandre Tkatchenko 1 collaboration

Zofia Trstanova 1 collaboration

Rafal Wiewiora 1 collaboration

Manuel Corral-Valero 1 collaboration

Ani Anciaux-Sedrakian 1 collaboration

Maxime Moreaud 1 collaboration

Pascal Raybaud 1 collaboration

Wei Zhang 1 collaboration

Z Trstanova 1 collaboration

B Leimkuhler 1 collaboration

T Lelièvre 1 collaboration

Charles-Edouard Bréhier 1 collaboration