A high performance toolkit for molecular simulation. Use it as a library, or as an application. We include extensive language bindings for Python, C, C++, and even Fortran. The code is open source and actively maintained on Github, licensed under MIT and LGPL. Part of the Omnia suite of tools for predictive biomolecular simulation.
Extreme flexibility through custom forces and integrators. Extreme performance through GPU Acceleration, with optimizations for AMD, NVIDIA, and Intel Integrated GPUs. It's fast on CPUs too. See the benchmarks.
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