Page - 115 - in Charge Transport in DNA - Insights from Simulations
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A.2Effect ofLowHydrationandDecreased IonContent
StabilizingForces forMicrohydratedDNA
TableA.3: Harmonic forceconstant(pN/nm)fortheDry1andDry2systemscompared
to the fully hydratedDNA. Force constant f calculated from the standard
deviation of the end-to-end distance σ of the particular DNA oligomer as
f = kBT/σ2.
sequence fullH2O Dry1 Dry2
A5 244 315 990
A9 225 406 331
A13 84 195 80
G5 582 187 402
G9 308 406 72
G13 79 97 515
115
Charge Transport in DNA
Insights from Simulations
- Title
- Charge Transport in DNA
- Subtitle
- Insights from Simulations
- Author
- Mario Wolter
- Publisher
- KIT Scientific Publishing
- Date
- 2013
- Language
- English
- License
- CC BY-SA 3.0
- ISBN
- 978-3-7315-0082-7
- Size
- 17.0 x 24.0 cm
- Pages
- 156
- Keywords
- Charge Transport, Charge Transfer, DNA, Molecular Dynamics, Quantum Mechanics
- Categories
- Naturwissenschaften Chemie
Table of contents
- Zusammenfassung 1
- Summary 3
- 1 Introduction 5
- 2 TheoreticalBackground 11
- 3 SimulationSetup 39
- 4 DNAUnderExperimentalConditions 49
- 5 ChargeTransport inStretchedDNA 69
- 6 ChargeTransport inMicrohydratedDNA 79
- 7 AParametrizedModel toSimulateCT inDNA 89
- 8 Conclusion 105
- Appendix 111
- A DNAUnderExperimentalConditions 111
- B CTinMicrohydratedDNA 117
- List ofPublications 137