BiophysicsbioRxiv
OpenMM 7: Rapid Development of High Performance Algorithms for Molecular Dynamics
P. Eastman, J. Swails, J. D. Chodera…·V. S. Pande
OpenMM 7 enables rapid development of high-performance molecular dynamics algorithms with extensible features that work across hardware types without modifying the core toolkit.
DOI 10.1371/journal.pcbi.1005659