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Exploring the Electronic Interactions of Adenine, Cytosine, and Guanine with Graphene: A DFT Study

Abstract This study has provided new insights into the interaction between graphene and DNA nucleobases (adenine, cytosine, and guanine). It compares how each nucleobase interacts with graphene, examining their selectivity and binding energy. The research also explores how these interactions impact...

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Principais autores: Jawaher Qasem, Baliram Lone
Format: Artigo
Sprog:Inglês
Udgivet: Wiley-VCH 2025-06-01
Serier:ChemistryOpen
Fag:
Density functional theory
Pure graphene
Adenine
Cytosine
Guanine
HOMO-LUMO
Online adgang:https://doi.org/10.1002/open.202400350
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