Rafael Ravedutti Lucio Machado, Jan Eitzinger, Jan Laukemann, Georg Hager, Harald Köstler, Gerhard Wellein. MD-Bench: A performance-focused prototyping harness for state-of-the-art short-range molecular dynamics algorithms. Future Generation Comp. Syst., 149:25-38, December 2023. [doi]
Abstract is missing.