most citedCharge transport through bio-molecular wires in a solvent: Bridging molecular dynamics and model Hamiltonian approaches

93 citations · 93 across the 1 of their papers we have counts for

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cond-mat.soft2009★ 93 cited

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…