Melo, ManuelBarriga, Rodrigo2023-03-242023-03-242023-02-10http://hdl.handle.net/10362/151163"Type II NADH Oxidoreductase (NDH-2) from Staphylococcus aureus was established as a therapeutic target against the virulency of this bacterium and an alternative to treat Complex I-derived diseases. To accurately model interactions of NDH-2 with its substrates such as menaquinones and NADH, Coarse-Grain (CG) simulations were employed. "engCoarse-GrainMartini 3master thesis203518810