TY - GEN AU - Sabri Dashti,Danial AU - Meng,Yilin AU - Roitberg,Adrian E TI - pH-replica exchange molecular dynamics in proteins using a discrete protonation method SN - 1520-5207 PY - 2012///1203 KW - Algorithms KW - Amino Acid Sequence KW - Hydrogen-Ion Concentration KW - Kinetics KW - Molecular Dynamics Simulation KW - Oligopeptides KW - chemistry KW - Protons N1 - Publication Type: Journal Article; Research Support, N.I.H., Extramural; Research Support, Non-U.S. Gov't UR - https://doi.org/10.1021/jp303385x ER -