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- W4306769251 abstract "A modification of the Adaptive Biasing Force method is introduced, in which the free energy is approximated by a sum of tensor products of one-dimensional functions. This enables to handle a larger number of reaction coordinates than the classical algorithm. We prove the algorithm is well-defined and prove the long-time convergence toward a regularized version of the free energy for an idealized version of the algorithm. Numerical experiments demonstrate that the method is able to capture correlations between reaction coordinates." @default.
- W4306769251 created "2022-10-19" @default.
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- W4306769251 date "2020-07-20" @default.
- W4306769251 modified "2023-10-10" @default.
- W4306769251 title "Adaptive force biasing algorithms: new convergence results and tensor approximations of the bias" @default.
- W4306769251 doi "https://doi.org/10.48550/arxiv.2007.09941" @default.
- W4306769251 hasPublicationYear "2020" @default.
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