Intrinsic dynamic and static nature of each HB in the multi-HBs between nucleobase pairs and its behavior, elucidated with QTAIM dual functional analysis and QC calculations

The intrinsic dynamic and static nature of each HB in the multi-HBs between nucleobase pairs (Nu–Nu′) is elucidated with QTAIM dual functional analysis (QTAIM-DFA). Perturbed structures generated using coordinates derived from the compliance constants (C(ii)) are employed for QTAIM-DFA. The method i...

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Detalles Bibliográficos
Autores principales: Nakanishi, Waro, Hayashi, Satoko, Nishide, Taro
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2020
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9055173/
https://www.ncbi.nlm.nih.gov/pubmed/35516213
http://dx.doi.org/10.1039/d0ra01357a

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9055173/
https://www.ncbi.nlm.nih.gov/pubmed/35516213
http://dx.doi.org/10.1039/d0ra01357a

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