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Authors
Pascal T. Merz (0000-0002-7045-8725), Wei-Tse Hsu, Matt W. Thompson, Simon Boothroyd, Chris C. Walker, Michael R. Shirts (0000-0003-3249-1097)
Citation
Merz et al., (2022). physical_validation: A Python package to assess the physical validity of molecular simulation results. Journal of Open Source Software, 7(69), 3981, https://doi.org/10.21105/joss.03981
@article{Merz2022,
doi = {10.21105/joss.03981},
url = {https://doi.org/10.21105/joss.03981},
year = {2022},
publisher = {The Open Journal},
volume = {7},
number = {69},
pages = {3981},
author = {Pascal T. Merz and Wei-Tse Hsu and Matt W. Thompson and Simon Boothroyd and Chris C. Walker and Michael R. Shirts},
title = {physical_validation: A Python package to assess the physical validity of molecular simulation results},
journal = {Journal of Open Source Software}
}
Tags
molecular simulation molecular dynamics molecular mechanics statistical mechanics physical validation
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