Methods for the establishment of enzymatic mechanisms - from QM to ML.

Neves RPP, Coimbra JTS, Paiva P, Raucci U, Das S, Calixto AR, Ribeiro AJM, Sousa JPM, Ferreira P, Trizio E, Fernandes PA, Parrinello M, Ramos MJ

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DOI: 10.1039/d6sc02180h
Published: 2026 Sep 2
Container: Chemical science
Publisher: Not recorded
Open access: yes

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Cite this work

BibTeX

@article{allodium:10.1039/d6sc02180h,
  title = {Methods for the establishment of enzymatic mechanisms - from QM to ML.},
  author = {Neves RPP and Coimbra JTS and Paiva P and Raucci U and Das S and Calixto AR and Ribeiro AJM and Sousa JPM and Ferreira P and Trizio E and Fernandes PA and Parrinello M and Ramos MJ},
  year = {2026},
  journal = {Chemical science},
  doi = {10.1039/d6sc02180h},
  url = {https://doi.org/10.1039/d6sc02180h}
}

RIS

TY  - JOUR
TI  - Methods for the establishment of enzymatic mechanisms - from QM to ML.
AU  - Neves RPP
AU  - Coimbra JTS
AU  - Paiva P
AU  - Raucci U
AU  - Das S
AU  - Calixto AR
AU  - Ribeiro AJM
AU  - Sousa JPM
AU  - Ferreira P
AU  - Trizio E
AU  - Fernandes PA
AU  - Parrinello M
AU  - Ramos MJ
PY  - 2026
JO  - Chemical science
DO  - 10.1039/d6sc02180h
UR  - https://doi.org/10.1039/d6sc02180h
ER  -

APA

RPP, N., JTS, C., P, P., U, R., S, D., AR, C., AJM, R., JPM, S., P, F., E, T., PA, F., M, P., & MJ, R. (2026). Methods for the establishment of enzymatic mechanisms - from QM to ML.. Chemical science. https://doi.org/10.1039/d6sc02180h

Source records

pubmed · retrieved 2026-09-25T06:39:41.041Z