Energy landscape of a peptide consisting of α‐helix, 3<sub>10</sub>‐helix, β‐turn, β‐hairpin, and other disordered conformations
Abstract The energy landscape of a peptide [Ace‐Lys‐Gln‐Cys‐Arg‐Glu‐Arg‐Ala‐Nme] in explicit water was studied with a multicanonical molecular dynamics simulation, and the AMBER...