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Gaussian-Accelerated Molecular Dynamics with the Weighted Ensemble Method: A Hybrid Method Improves Thermodynamic and

Surl-Hee Ahn1, Anupam A Ojha1, Rommie E Amaro1

  • 1Department of Chemistry, University of California San Diego, La Jolla 92093, California, United States.

Journal of Chemical Theory and Computation
|November 30, 2021
PubMed

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