Data-Driven Free-Energy Learning from Trajectories via Structure-Preserving Exponential Time Differencing (Q7374664)
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| English | Data-Driven Free-Energy Learning from Trajectories via Structure-Preserving Exponential Time Differencing |
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Data-Driven Free-Energy Learning from Trajectories via Structure-Preserving Exponential Time Differencing (English)
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8 October 2026
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math.NA
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Wenshuai Hu
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Guanghua Ji
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Xiao Li
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We learn a structure-preserving evolution operator for gradient flows from trajectories using a novel Duhamel-based learning framework that reconstructs an inferred free energy, enabling unconditional dissipation of the learned energy and maximum-bound principle preservation.
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Data-Driven
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Free-Energy Learning
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Trajectory Inference
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Structure-Preserving
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