Minimal normalizing flows with low-dimensional physically informed transformations accelerate chemical potential calculations by factors of 3-10x in Lennard-Jones and aqueous ion systems while training in one minute on GPU.
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Accelerating Chemical Potential Calculations with Minimal Normalizing Flows
Minimal normalizing flows with low-dimensional physically informed transformations accelerate chemical potential calculations by factors of 3-10x in Lennard-Jones and aqueous ion systems while training in one minute on GPU.