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Mario Wolter

Charge Transport in DNA - Insights from Simulations

AutorWolter, Mario

VerlagKIT Scientific Publishing, Karlsruhe

ISBN9783731500827

UmfangVI, 139 S.

Veröffentlicht
am:
30.09.2013

Erscheinungs-
jahr
2013

VerfügbarkeitAktiv

Downloads:

Für Zitate bitte die folgende URL verwenden:
http://dx.doi.org/10.5445/KSP/1000036065

Abstract

Charge transport and charge transfer (CT) capabilities of deoxyribonucleic acid (DNA) are investigated. A QM/MM multi-scale framework is applied to calculate the CT capabilities of DNA under conditions resembling the experimental setup. The simulations are able to explain and predict the outcome of experiments and therefore make suggestions in advance. Based on the findings, suitable DNA sequences can be opted for the design of DNA-based devices as nano-scale electronic elements.