Forces are not Enough: Benchmark and Critical Evaluation for Machine Learning Force Fields with Molecular Simulations.
Trans. Mach. Learn. Res., 2023
Learning Pair Potentials using Differentiable Simulations.
CoRR, 2022
Generative Coarse-Graining of Molecular Conformations.
Proceedings of the International Conference on Machine Learning, 2022
An End-to-End Framework for Molecular Conformation Generation via Bilevel Programming.
Proceedings of the 38th International Conference on Machine Learning, 2021
Differentiable Molecular Simulations for Control and Learning.
CoRR, 2020
Variational Coarse-Graining for Molecular Dynamics.
CoRR, 2018
GA-BPNN Based Hybrid Steering Control Approach for Unmanned Driving Electric Vehicle with In-Wheel Motors.
Complex., 2018