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Signed-off-by: Andrew Clemons <andrew.clemons@gmail.com> Signed-off-by: Willy Sudiarto Raharjo <willysr@slackbuilds.org> |
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| .. | ||
| OpenMM.info | ||
| OpenMM.SlackBuild | ||
| README | ||
| slack-desc | ||
A high-performance toolkit for molecular simulation. Use it as an application, a library, or a flexible programming environment. We include extensive language bindings for Python, C, C++, and even Fortran. If you want to build the Python package set the environment variable PYTHON=yes (this requires numpy3). NOTE: if you want to use the python module with OpenCL you shall, install a OpenCL runtime, such as pocl, or other vendor specific.