Optimal Reaction Coordinates: Variational Characterization and Sparse Computation

Andreas Bittracher, Mattes Mollenhauer, Péter Koltai, Christof Schütte. Optimal Reaction Coordinates: Variational Characterization and Sparse Computation. Multiscale Modeling & Simulation, 21(2):449-488, June 2023. [doi]

Authors

Andreas Bittracher

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Mattes Mollenhauer

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Péter Koltai

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Christof Schütte

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