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stat.ML2026
Bridging Stochastic Flow Maps and Boltzmann Generators with Normalizing Flows
Louis Grenioux, RuiKang OuYang, Luhuan Wu
Generating independent, equilibrium samples of molecular systems at scale remains a central obstacle in computational statistical mechanics. Boltzmann Generators address this by pa…
cs.LG2026★ 4 cited
Robust Inference-Time Steering of Protein Diffusion Models via Embedding Optimization
Minhuan Li, Jiequn Han, Pilar Cossio +1
A core challenge in structural biophysics is generating biomolecular conformations that are both physically plausible and consistent with experimental measurements. While sequence-…