Data-Driven Collective Variables for Enhanced Sampling

Summary

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Authors: Luigi Bonati, Valerio Rizzi, Michele Parrinello

Journal title: The Journal of Physical Chemistry Letters

Journal number: 11/8

Journal publisher: American Chemical Society

Published year: 2020

Published pages: 2998-3004

DOI identifier: 10.1021/acs.jpclett.0c00535

ISSN: 1948-7185