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First principles effective electronic couplings for hole transfer in natural and size-expanded DNA
Hole transfer processes between base pairs in natural DNA and size-expanded DNA (xDNA) are studied and compared, by means of an accurate first principles evaluation of the effective electronic couplings (also known as transfer integrals), in order to assess the effect of the base augmentation on the...
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| Main Authors: | , , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2009
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2737706/ https://ncbi.nlm.nih.gov/pubmed/19537767 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp904295q |
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