QM/MM hybrid simulation of enzyme-Mn synergistic catalysis for quinazolinones: computational determination of activation energy and transition state.

Cao H

DOI: 10.3389/fchem.2026.1792714
Published: 2026
Container: Frontiers in chemistry
Publisher: Not recorded
Open access: yes

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Cite this work

BibTeX

@article{allodium:10.3389/fchem.2026.1792714,
  title = {QM/MM hybrid simulation of enzyme-Mn synergistic catalysis for quinazolinones: computational determination of activation energy and transition state.},
  author = {Cao H},
  year = {2026},
  journal = {Frontiers in chemistry},
  doi = {10.3389/fchem.2026.1792714},
  url = {https://doi.org/10.3389/fchem.2026.1792714}
}

RIS

TY  - JOUR
TI  - QM/MM hybrid simulation of enzyme-Mn synergistic catalysis for quinazolinones: computational determination of activation energy and transition state.
AU  - Cao H
PY  - 2026
JO  - Frontiers in chemistry
DO  - 10.3389/fchem.2026.1792714
UR  - https://doi.org/10.3389/fchem.2026.1792714
ER  -

APA

H, C. (2026). QM/MM hybrid simulation of enzyme-Mn synergistic catalysis for quinazolinones: computational determination of activation energy and transition state.. Frontiers in chemistry. https://doi.org/10.3389/fchem.2026.1792714

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pubmed · retrieved 2026-09-26T12:55:10.183Z