A review summarizing AI techniques for protein conformation generation, trajectory modeling, Boltzmann generators, machine learning potentials, and related challenges in scalability and physical consistency.
F3low: Frame-to-frame coarse-grained molecular dynamics with se (3) guided flow matching.arXiv preprint arXiv:2405.00751
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Learning Structure, Energy, and Dynamics: A Survey of Artificial Intelligence for Protein Dynamics
A review summarizing AI techniques for protein conformation generation, trajectory modeling, Boltzmann generators, machine learning potentials, and related challenges in scalability and physical consistency.