A variational conformational dynamics approach to the selection of collective variables in metadynamics

Summary

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Authors: James McCarty, Michele Parrinello

Journal title: The Journal of Chemical Physics

Journal number: 147/20

Journal publisher: American Institute of Physics

Published year: 2017

Published pages: 204109

DOI identifier: 10.1063/1.4998598

ISSN: 0021-9606