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most citedOXtal: An All-Atom Diffusion Model for Organic Crystal Structure Prediction

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cs.LG2025

Efficient Regression-Based Training of Normalizing Flows for Boltzmann Generators

Danyal Rehman, Oscar Davis, Jiarui Lu +5

Simulation-free training frameworks have been at the forefront of the generative modelling revolution in continuous spaces, leading to large-scale diffusion and flow matching model…