Sequence and conformation effects on ionization potential and charge distribution of homo-nucleobase stacks using M06-2X hybrid density functional theory calculations

DNA is subject to oxidative damage due to radiation or by-products of cellular metabolism, thereby creating electron holes that migrate along the DNA stacks. A systematic computational analysis of the dependence of the electronic properties of nucleobase stacks on sequence and conformation was perfo...

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Detalles Bibliográficos
Autores principales: Rooman, Marianne, Wintjens, René
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Taylor & Francis 2013
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3919198/
https://www.ncbi.nlm.nih.gov/pubmed/23582046
http://dx.doi.org/10.1080/07391102.2013.783508

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3919198/
https://www.ncbi.nlm.nih.gov/pubmed/23582046
http://dx.doi.org/10.1080/07391102.2013.783508

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