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Surprising Conformers of the Biologically Important A·T DNA Base Pairs: QM/QTAIM Proofs

For the first time novel high-energy conformers–A·T(w(WC)) (5.36), A·T(w(rWC)) (5.97), A·T(w(H)) (5.78), and A·T(w(rH)) (ΔG = 5.82 kcal·mol(−1)) (See Graphical Abstract) were revealed for each of the four biologically important A·T DNA base pairs – Watson-Crick A·T(WC), reverse Watson-Crick A·T(rWC)...

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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: Frontiers Media S.A. 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5835050/
https://www.ncbi.nlm.nih.gov/pubmed/29536003
http://dx.doi.org/10.3389/fchem.2018.00008