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DOE OSTI · 1664623

A restrained locally enhanced sampling method (RLES) for finding free energy minima in complex systems

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Ovchinnikov, Victor, Conti, Simone, Karplus, Martin. 2020-09-28. A restrained locally enhanced sampling method (RLES) for finding free energy minima in complex systems. https://doi.org/10.1063/5.0018026

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