This release is for use with OpenMM 3.0.
M. S. Friedrichs, P. Eastman, V. Vaidyanathan, M. Houston, S. LeGrand, A. L. Beberg, D. L. Ensign, C. M. Bruns, V. S. Pande. “Accelerating Molecular Dynamic Simulation on Graphics Processing Units.” J. Comp. Chem., 30(6), 864-872. (2009) View
Please cite this website https://simtk.org/home/pyopenmm in any published work which utilizes PyOpenMM. (2009)
Python wrappers, including the OpenMM 2.0.0 libraries. Requires Cuda 3.1
Python wrappers, including the OpenMM 1.1.1 libraries. Used Cuda 2.3