Veröffentlichungen
(8) A. Heck, P. B. Woiczikowski, T. Kubař, B.Giese, M. Elstner, and T. Steinbrecher, "Charge Transfer in Model Peptides: Obtaining Marcus Parameters from Molecular Simulation", Journal of Physical Chemistry B, 116(7), 2284–2293, 2012. Link to article
(7) M. Wolter, P. B. Woiczikowski, M. Elstner, and T. Kubař, "Response of the electric conductivity of double-stranded DNA on moderate mechanical stretching stresses", Physical Review B, 85(7), 075101, 2012. Link to article
(6) P. B. Woiczikowski, T. Steinbrecher, T. Kubař and M. Elstner, "Nonadiabatic QM/MM Simulations of Fast Charge Transfer in Escherichia coli DNA Photolyase ", Journal of Physical Chemistry B, 115(32), 9846–9863, 2011. Link to article
(5) P. B. Woiczikowski, T. Kubař, R. Gutiérrez, G. Cuniberti, and M. Elstner, "Structural stability versus conformational sampling in biomolecular systems: Why is the charge transfer efficiency in G4-DNA better than in double-stranded DNA?", Journal of Chemical Physics, 133(035103), 2010. Link to article
(4) R. Gutiérrez, R. A. Caetano, P. B. Woiczikowski, T. Kubař, M. Elstner, and G. Cuniberti, "Structural fluctuations and quantum transport through DNA molecular wires: a combined molecular dynamics and model Hamiltonian approach", NEW JOURNAL OF PHYSICS, 12(2), 023022, 2010. Link to article
(3) P. B. Woiczikowski, T. Kubař, R. Gutiérrez, R. A. Caetano, G. Cuniberti, and M. Elstner, "Combined density functional theory and landauer approach for hole transfer in DNA along classical molecular dynamics trajectories", Journal of Chemical Physics, 130(21), 215104, 2009. Link to article
(2) R. Gutiérrez, R. A. Caetano, P. B. Woiczikowski, T. Kubař, M. Elstner, and G. Cuniberti, "Charge transport through biomolecular wires in a solvent: Bridging molecular dynamics and model hamiltonian approaches", Physical Review Letters, 102(20), 208102, 2009. Link to article
(1) T. Kubař, P. B. Woiczikowski, G. Cuniberti, and M. Elstner, "Efficient calculation of charge-transfer matrix elements for hole transfer in DNA", Journal of Physical Chemistry B, 112(26), 7937–7947, 2008. Link to article