Charge Transport in DNA - Insights from Simulations

Charge Transport in DNA - Insights from Simulations

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...

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Wolter, Mario
Year of Publication:2013
Language:English
Physical Description:1 electronic resource (VI, 139 p. p.)
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record_format marc
spelling Wolter, Mario auth
Charge Transport in DNA - Insights from Simulations
KIT Scientific Publishing 2013
1 electronic resource (VI, 139 p. p.)
text txt rdacontent
computer c rdamedia
online resource cr rdacarrier
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.
English
Charge Transfer
Molecular Dynamics
Charge Transport
Quantum Mechanics
DNA
3-7315-0082-5
language English
format eBook
author Wolter, Mario
spellingShingle Wolter, Mario
Charge Transport in DNA - Insights from Simulations
author_facet Wolter, Mario
author_variant m w mw
author_sort Wolter, Mario
title Charge Transport in DNA - Insights from Simulations
title_full Charge Transport in DNA - Insights from Simulations
title_fullStr Charge Transport in DNA - Insights from Simulations
title_full_unstemmed Charge Transport in DNA - Insights from Simulations
title_auth Charge Transport in DNA - Insights from Simulations
title_new Charge Transport in DNA - Insights from Simulations
title_sort charge transport in dna - insights from simulations
publisher KIT Scientific Publishing
publishDate 2013
physical 1 electronic resource (VI, 139 p. p.)
isbn 3-7315-0082-5
illustrated Not Illustrated
work_keys_str_mv AT woltermario chargetransportindnainsightsfromsimulations
status_str n
ids_txt_mv (CKB)4920000000101904
(oapen)https://directory.doabooks.org/handle/20.500.12854/43023
(EXLCZ)994920000000101904
carrierType_str_mv cr
is_hierarchy_title Charge Transport in DNA - Insights from Simulations
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