Reproducibility of QM/MM Calculations for the SARS-CoV-2 Main Protease.

Sun X, Ryde U

DOI: 10.1021/acs.jctc.5c00841
Published: 2025 Aug 12
Container: Journal of chemical theory and computation
Publisher: Not recorded
Open access: yes

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Cite this work

BibTeX

@article{allodium:10.1021/acs.jctc.5c00841,
  title = {Reproducibility of QM/MM Calculations for the SARS-CoV-2 Main Protease.},
  author = {Sun X and Ryde U},
  year = {2025},
  journal = {Journal of chemical theory and computation},
  doi = {10.1021/acs.jctc.5c00841},
  url = {https://doi.org/10.1021/acs.jctc.5c00841}
}

RIS

TY  - JOUR
TI  - Reproducibility of QM/MM Calculations for the SARS-CoV-2 Main Protease.
AU  - Sun X
AU  - Ryde U
PY  - 2025
JO  - Journal of chemical theory and computation
DO  - 10.1021/acs.jctc.5c00841
UR  - https://doi.org/10.1021/acs.jctc.5c00841
ER  -

APA

X, S., & U, R. (2025). Reproducibility of QM/MM Calculations for the SARS-CoV-2 Main Protease.. Journal of chemical theory and computation. https://doi.org/10.1021/acs.jctc.5c00841

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pubmed · retrieved 2026-09-26T16:43:51.042Z