A Minimal Membrane Metal Transport System: Dynamics and Energetics of mer Proteins. - Hyea Hwang; Anthony Hazel; Peng Lian; Jeremy C. Smith; James C. Gumbart; Jerry M. Parks (J. Comput. Chem., 2020)

GPU-specific algorithms for improved solute sampling in grand canonical Monte Carlo simulations. - Mingtian Zhao; Abhishek A. Kognole; Sunhwan Jo; Aoxiang Tao; Anthony Hazel; Alexander D. MacKerell Jr. (J. Comput. Chem., 2023)