Publications
Effective data-driven collective variables for free energy calculations from metadynamics of paths
Author(s):
Lukas Müllender, Andrea Rizzi, Michele Parrinello, Paolo Carloni, Davide Mandelli
Published in:
PNAS Nexus, Issue Volume 3, Issue 4, April 2024, pgae159, 2024, ISSN 2752-6542
Publisher:
Oxford University Press
DOI:
10.1093/pnasnexus/pgae159
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