Search papers, labs, and topics across Lattice.
IFP Energies Nouvelles, Rond-Point de l’Echangeur de Solaize, BP 3, 69360 Solaize, France
2
0
1
7
A new loss function based on Itô's formula significantly improves the learning of committor functions, enhancing rare event simulations in molecular dynamics.
Girsanov reweighting enables efficient uncertainty propagation in MLIPs, transforming how we calculate reaction rates in rare-event kinetics.
