High-temperature, solvent-induced proton transfer and double proton transfer in adenine–thymine replaced with deazaadenine

One way to improve DNA conductivity is to change the mobility of carriers via functional group modification. Based on molecular dynamics calculations, this paper discusses proton transfer between bases after replacing the nitrogen atoms at the 3 and 7 positions in adenine by carbon and hydrogen. At...

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Bibliographic Details
Main Authors: Guiqing Zhang, Yao Wei
Format: Article
Language:English
Published: AIP Publishing LLC 2020-12-01
Series:AIP Advances
Online Access:http://dx.doi.org/10.1063/5.0027057