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10 lines
450 B
Text
10 lines
450 B
Text
A high-performance toolkit for molecular simulation. Use it as an
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application, a library, or a flexible programming environment. We
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include extensive language bindings for Python, C, C++, and even
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Fortran.
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If you want to build the Python package set the environment
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variable PYTHON=yes (this requires numpy3).
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NOTE: if you want to use the python module with OpenCL you shall,
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install a OpenCL runtime, such as pocl, or other vendor specific.
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