OpenMM¶
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.
Environment Modules¶
Run module spider OpenMM to find out what environment modules are available for this application.
System Variables¶
- HPC_OPENMM_DIR - Installation directory
- HPC_OPENMM_BIN - Executable directory
- HPC_OPENMM_LIB - Library directory
- OPENMM_DIR - OpenMM Installation directory
- OPENMM_PLUGIN_DIR - OpenMM Plugin directory
- OPENMM_CUDA_COMPILER - OpenMM CUDA Compiler