research
∙
02/14/2023
Statistically Optimal Force Aggregation for Coarse-Graining Molecular Dynamics
Machine-learned coarse-grained (CG) models have the potential for simula...
share
research
∙
12/14/2022
Machine Learning Coarse-Grained Potentials of Protein Thermodynamics
A generalized understanding of protein dynamics is an unsolved scientifi...
research
∙
06/14/2021
Machine Learning Implicit Solvation for Molecular Dynamics
Accurate modeling of the solvent environment for biological molecules is...
research
∙
07/22/2020