Ensembles Are Required to Handle Aleatoric and Parametric Uncertainty in Molecular Dynamics Simulation
- DOI
- 10.1021/acs.jctc.1c00526
- Published
- 2021-07-19
- Container
- Journal of Chemical Theory and Computation
- Publisher
- American Chemical Society (ACS)
- Open access
- unknown
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Cite this work
BibTeX
@article{allodium:10.1021/acs.jctc.1c00526,
title = {Ensembles Are Required to Handle Aleatoric and Parametric Uncertainty in Molecular Dynamics Simulation},
author = {Maxime Vassaux and Shunzhou Wan and Wouter Edeling and Peter V. Coveney},
year = {2021},
journal = {Journal of Chemical Theory and Computation},
doi = {10.1021/acs.jctc.1c00526},
url = {https://doi.org/10.1021/acs.jctc.1c00526}
}RIS
TY - JOUR TI - Ensembles Are Required to Handle Aleatoric and Parametric Uncertainty in Molecular Dynamics Simulation AU - Maxime Vassaux AU - Shunzhou Wan AU - Wouter Edeling AU - Peter V. Coveney PY - 2021 JO - Journal of Chemical Theory and Computation DO - 10.1021/acs.jctc.1c00526 UR - https://doi.org/10.1021/acs.jctc.1c00526 ER -
APA
Vassaux, M., Wan, S., Edeling, W., & Coveney, P. V. (2021). Ensembles Are Required to Handle Aleatoric and Parametric Uncertainty in Molecular Dynamics Simulation. Journal of Chemical Theory and Computation. https://doi.org/10.1021/acs.jctc.1c00526
Source records
- crossref · retrieved 2026-09-25T10:04:38.669Z