Computational Modelling of Protein, DNA and Membrane Processes

The computational simulation of biological processes is a complex task which requires the combination of different quantum and classical mechanical approaches within a dynamic framework. In this contribution, different biological events, recently investigated by our research group MoBioChem, will be discussed, including the permeation of drugs across lipid membranes, charge transfer events on DNA, the binding of photoswitches to proteins, and the ion conduction through voltage-gated ion channels, among others.