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Sponsored Artificial Intelligence: A Modern Approach, Global Edition Artificial Intelligence: A Modern Approach, Global Edition

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Francisco Vargas

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#machine learning Open access Apr 2025

FEAT: Free energy Estimators with Adaptive Transport

A novel framework for free energy estimation that leverages learned transports implemented via stochastic interpolants and provides consistent, minimum-variance estimators based on escorted Jarzynski equality and controlled Crooks theorem, alongside variational upper and lower bounds on free energy differences.

Jiajun He, Yuan-Qi Du, Francisco Vargas et al. · 23 citations · ⚡1

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