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physics.comp-ph2022★ 5 cited
Learning Mappings between Equilibrium States of Liquid Systems Using Normalizing Flows
Alessandro Coretti, Sebastian Falkner, Phillip Geissler +1
Generative models are a promising tool to address the sampling problem in multi-body and condensed-matter systems in the framework of statistical mechanics. In this work, we show t…
physics.comp-ph2022★ 3 cited
Conditioning Normalizing Flows for Rare Event Sampling
Sebastian Falkner, Alessandro Coretti, Salvatore Romano +2
Understanding the dynamics of complex molecular processes is often linked to the study of infrequent transitions between long-lived stable states. The standard approach to the samp…