Data-Driven Path Collective Variables - Sorbonne Université
Journal Articles Journal of Chemical Theory and Computation Year : 2024

Data-Driven Path Collective Variables

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Theoretical and/or physical chemistry Artificial Intelligence [cs.AI] Statistical Mechanics [cond-mat.stat-mech]
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Arthur France-Lanord  : Connect in order to contact the contributor

https://hal.sorbonne-universite.fr/hal-04549936

Submitted on : Wednesday, April 17, 2024-2:37:13 PM

Last modification on : Friday, May 31, 2024-12:52:15 PM

Long-term archiving on : Friday, July 19, 2024-8:28:19 AM

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hal-04549936 , version 1 (17-04-2024)

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Arthur France-Lanord, Hadrien Vroylandt, Mathieu Salanne, Benjamin Rotenberg, A. Marco Saitta, et al.. Data-Driven Path Collective Variables. Journal of Chemical Theory and Computation, 2024, ⟨10.1021/acs.jctc.4c00123⟩. ⟨hal-04549936⟩

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