The A·T(rWC)/A·T(H)/A·T(rH) ↔ A·T*(rw(WC))/A·T*(w(H))/A·T*(rw(H)) mutagenic tautomerization via sequential proton transfer: a QM/QTAIM study

In this study for the first time we have revealed by QM and QTAIM calculations at the MP2/aug-cc-pVDZ//B3LYP/6-311++G(d,p) level of QM theory the novel routes of the mutagenic tautomerization of three biologically important A·T DNA base pairs – reverse Watson–Crick A·T(rWC), Hoogsteen A·T(H) and rev...

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Detalles Bibliográficos
Autores principales: Brovarets', Ol'ha O., Tsiupa, Kostiantyn S., Hovorun, Dmytro M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2018
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9079753/
https://www.ncbi.nlm.nih.gov/pubmed/35542561
http://dx.doi.org/10.1039/c8ra01446a

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9079753/
https://www.ncbi.nlm.nih.gov/pubmed/35542561
http://dx.doi.org/10.1039/c8ra01446a

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