93 citations · 273 across the 5 of their papers we have counts for
5 papers
Tracking the Electron Transfer Cascade in European Robin Cryptochrome 4 Mutants
Daniel Timmer, Daniel C. Lünemann, Anitta R. Thomas +8
The primary step in the elusive ability of migratory birds to sense weak Earth-strength magnetic fields is supposedly the light-induced formation of a long-lived, magnetically sens…
Reaction Path Averaging: Characterizing the Structural Response of the DNA Double Helix to Electron Transfer
Michal H. Kolář, Tomáš Kubař
A polarizable environment, prominently the solvent, responds to electronic changes in biomolecules rapidly. The knowledge of conformational relaxation of the biomolecule itself, ho…
Structural stability versus conformational sampling in biomolecular systems: Why is the charge transfer efficiency in G4-DNA better than in double-stranded DNA?
P. Benjamin Woiczikowski, Tomáš Kubař, Rafael Gutiérrez +2
The electrical conduction properties of G4-DNA are investigated using a hybrid approach, which combines electronic structure calculations, molecular dynamics (MD) simulations, and…
Structural fluctuations and quantum transport through DNA molecular wires: a combined molecular dynamics and model Hamiltonian approach
R. Gutierrez, R. Caetano, P. B. Woiczikowski +3
Charge transport through a short DNA oligomer (Dickerson dodecamer) in presence of structural fluctuations is investigated using a hybrid computational methodology based on a combi…
Charge transport through bio-molecular wires in a solvent: Bridging molecular dynamics and model Hamiltonian approaches
R. Gutierrez, R. Caetano, P. B. Woiczikowski +3
We present a hybrid method based on a combination of quantum/classical molecular dynamics (MD) simulations and a mod el Hamiltonian approach to describe charge transport through bi…