Search Results for author: Ellis R. Crabtree

Found 2 papers, 0 papers with code

Micro-Macro Consistency in Multiscale Modeling: Score-Based Model Assisted Sampling of Fast/Slow Dynamical Systems

no code implementations10 Dec 2023 Ellis R. Crabtree, Juan M. Bello-Rivas, Ioannis G. Kevrekidis

A valuable step in the modeling of multiscale dynamical systems in fields such as computational chemistry, biology, materials science and more, is the representative sampling of the phase space over long timescales of interest; this task is not, however, without challenges.

GANs and Closures: Micro-Macro Consistency in Multiscale Modeling

no code implementations23 Aug 2022 Ellis R. Crabtree, Juan M. Bello-Rivas, Andrew L. Ferguson, Ioannis G. Kevrekidis

In this work, we present an approach that couples physics-based simulations and biasing methods for sampling conditional distributions with ML-based conditional generative adversarial networks for the same task.

Dimensionality Reduction Protein Folding

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