openmm-dlext (conda): The plugin is intended to provide a OpenMM::Force derived class that does no direct computation, but instead uses DLPack wrappers around CPU or GPU OpenMM::Platform data for an initialized instance of OpenMM::Contex, and a callback interface to perform computations on such data outside the plugin.
Keywords: enhanced-sampling|miccom|openmm|openmm-plugin|pysages