Is the DPT tautomerization of the long A·G Watson-Crick DNA base mispair a source of the adenine and guanine mutagenic tautomers? A QM and QTAIM response to the biologically important question

Is the DPT tautomerization of the long A·G Watson-Crick DNA base mispair a source of the adenine and guanine mutagenic tautomers? A QM and QTAIM response to the biologically important question

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Détails bibliographiques
Publié dans:Journal of computational chemistry. - 1984. - 35(2014), 6 vom: 05. März, Seite 451-66
Auteur principal: Brovarets', Ol'ha O (Auteur)
Autres auteurs: Zhurakivsky, Roman O, Hovorun, Dmytro M
Format: Article en ligne
Langue:English
Publié: 2014
Accès à la collection:Journal of computational chemistry
Sujets:Journal Article Research Support, Non-U.S. Gov't B3LYP and MP2 levels of QM theory CH···N H-bond NBO parameters along the IRC NH···HC dihydrogen bond QTAIM analysis adenine·guanine (A·G) DNA base mispair amino and imino tautomers of the adenine cooperativity of the H-bonds plus... electron-topological geometric keto and enol tautomers of the guanine polar sweeps of the energetic the double proton transfer Guanine 5Z93L87A1R Adenine JAC85A2161
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