Monte Carlo – Metropolis-Hastings

Meilerlab is intensly involved in developing new algorithms for Rosetta involving Monte carlo (MC) -Metropolis algorithm. The role of Meiler lab in utilizing MC is many folds including Antiboby design algorithm, Enzyme design, small molecule drug discovery, peptide docking, membrane protein simulations and peptide docking. These protocol extensively involved the implementation of MC based method in Rosetta.