Collective variable-based enhanced sampling and machine learning

Chen, Ming

doi:10.1140/epjb/s10051-021-00220-w

Collective variable-based enhanced sampling and machine learning

Journal Article · 01 October 2021 · European Physical Journal. B, Condensed Matter and Complex Systems

DOI:https://doi.org/10.1140/epjb/s10051-021-00220-w· OSTI ID:1982999

Not provided.

Research Organization:: Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States). Center for Computational Study of Excited State Phenomena in Energy Materials (C2SEPEM)

Sponsoring Organization:: USDOE

DOE Contract Number:: AC02-05CH11231

OSTI ID:: 1982999

Journal Information:: European Physical Journal. B, Condensed Matter and Complex Systems, Vol. 94, Issue 10; ISSN 1434-6028

Publisher:: Springer

Country of Publication:: United States

Language:: English

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