P. B. Woiczikowski

发表

Development and Application of Efficient Methods for the Simulation of Charge Transport in Complex Biomolecules

P. B. Woiczikowski, 2011 .

Charge transfer in E. coli DNA photolyase: understanding polarization and stabilization effects via QM/MM simulations.

M. Elstner, T. Steinbrecher, T. Kubař, 2013, The journal of physical chemistry. B.

Charge transfer in model peptides: obtaining Marcus parameters from molecular simulation.

M. Elstner, B. Giese, T. Steinbrecher, 2012, The journal of physical chemistry. B.

Fragment orbital based description of charge transfer in peptides including backbone orbitals.

K. Welke, M. Elstner, B. Giese, 2014, The journal of physical chemistry. B.

Nonadiabatic QM/MM simulations of fast charge transfer in Escherichia coli DNA photolyase.

M. Elstner, T. Steinbrecher, T. Kubař, 2011, The journal of physical chemistry. B.

Structural fluctuations and quantum transport through DNA molecular wires: a combined molecular dynamics and model Hamiltonian approach

G. Cuniberti, M. Elstner, T. Kubař, 2009, 0910.0348.

Structural stability versus conformational sampling in biomolecular systems: why is the charge transfer efficiency in G4-DNA better than in double-stranded DNA?

G. Cuniberti, M. Elstner, T. Kubař, 2010, The Journal of chemical physics.

Combined density functional theory and Landauer approach for hole transfer in DNA along classical molecular dynamics trajectories.

G. Cuniberti, M. Elstner, T. Kubař, 2009, The Journal of chemical physics.

Efficient calculation of charge-transfer matrix elements for hole transfer in DNA.

Gianaurelio Cuniberti, Marcus Elstner, Tomás Kubar, 2008, The journal of physical chemistry. B.

Time-dependent view of sequential transport through molecules with rapidly fluctuating bridges.

B. Popescu, M. Elstner, P. B. Woiczikowski, 2012, Physical review letters.

Response of the electric conductivity of double-stranded DNA on moderate mechanical stretching stresses

M. Elstner, T. Kubař, P. B. Woiczikowski, 2012 .