Journal Article 2 generalized ensemble method 25104-18-1 1 Oligopeptides 1 Polylysine 1 Research Support, Non-U.S. Gov't 1 all-atom model 1 mehr ... conformational sampling 1 cutoff based method 1 electrostatic interaction 1 explicit water 1 free energy landscape 1 molecular dynamics simulation 1 partial system 1 weniger ...