Convergence of metadynamics: discussion of the adiabatic hypothesis
Probability
2019-04-19 v1 Computational Physics
Abstract
By drawing a parallel between metadynamics and self interacting models for polymers, we study the longtime convergence of the original metadynamics algorithm in the adiabatic setting, namely when the dynamics along the collective variables decouples from the dynamics along the other degrees of freedom. We also discuss the bias which is introduced when the adiabatic assumption does not holds.
Cite
@article{arxiv.1904.08667,
title = {Convergence of metadynamics: discussion of the adiabatic hypothesis},
author = {Benjamin Jourdain and Tony Lelièvre and Pierre-André Zitt},
journal= {arXiv preprint arXiv:1904.08667},
year = {2019}
}