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Andrew Clemons
2835dbd259
academic/OpenMM: Fix github tarball handling.
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2 lat temu | |
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| .. | ||
| OpenMM.SlackBuild | 2835dbd259 academic/OpenMM: Fix github tarball handling. | 2 lat temu |
| OpenMM.info | 2835dbd259 academic/OpenMM: Fix github tarball handling. | 2 lat temu |
| README | 24f7e9543e academic/OpenMM: Added (high-perf toolkit for molecular simulation) | 2 lat temu |
| slack-desc | 24f7e9543e academic/OpenMM: Added (high-perf toolkit for molecular simulation) | 2 lat temu |
README
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.
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.