Affiliation: | 1.Center for High Performance Simulations (CHiPS) and Department of Physics, North Carolina State University, Raleigh, North Carolina, United States of America;2.Department of Chemistry and Biochemistry, UC San Diego, La Jolla, California, United States of America;3.Department of Molecular and Structural Biochemistry, North Carolina State University, Raleigh, North Carolina, United States of America;University of Maryland, Baltimore, United States of America |