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OpenMM

OpenMM is a toolkit for molecular simulation.

homepage: https://simtk.org/home/openmm

version versionsuffix toolchain
7.1.1 -Python-3.6.3 intel/2017b
7.4.1 -Python-3.7.4 foss/2019b
7.4.1 -Python-3.7.4 fosscuda/2019b
7.4.1 -Python-3.7.4 intel/2019b
7.4.2 -Python-3.8.2 intel/2020a
7.5.0 foss/2020b
7.5.0 -Python-3.8.2 fosscuda/2020a
7.5.0 fosscuda/2020b
7.5.0 -Python-3.8.2 intel/2020a
7.5.0 intel/2020b
7.5.1 foss/2020b
7.5.1 -CUDA-11.3.1-DeepMind-patch foss/2021a
7.5.1 -DeepMind-patch foss/2021a
7.5.1 -CUDA-11.4.1-DeepMind-patch foss/2021b
7.5.1 -DeepMind-patch foss/2021b
7.5.1 fosscuda/2020b
7.7.0 -CUDA-11.3.1 foss/2021a
7.7.0 foss/2021a
7.7.0 -CUDA-11.7.0 foss/2022a
7.7.0 foss/2022a
8.0.0 -CUDA-11.7.0 foss/2022a
8.0.0 foss/2022a
8.0.0 -CUDA-12.1.1 foss/2023a
8.0.0 foss/2023a

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