mirror of https://github.com/TREX-CoE/qmckl.git
78 lines
2.9 KiB
Python
78 lines
2.9 KiB
Python
#!/usr/bin/env python3
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"""
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setup.py file for qmckl package
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"""
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import os, sys
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from setuptools import setup, Extension
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from os.path import join
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# Read the long description
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with open("README.md", "r") as fh:
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long_description = fh.read()
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# this was recommended to solve the problem of the missing numpy header files
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try:
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import numpy
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except ImportError:
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raise Exception("numpy Python package cannot be imported.")
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numpy_includedir = numpy.get_include()
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# Define the name of the Python package
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MODULE_NAME = "qmckl"
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# derive the QMCkl libdir and includedir
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QMCKL_LIBDIR = os.environ.get("QMCKL_LIBDIR", None)
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QMCKL_INCLUDEDIR = os.environ.get("QMCKL_INCLUDEDIR", None)
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libdir_undefined = QMCKL_LIBDIR is None or QMCKL_LIBDIR==""
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includedir_undefined = QMCKL_INCLUDEDIR is None or QMCKL_INCLUDEDIR==""
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# Define qmckl extension module based on SWIG interface file (requires qmckl.h)
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qmckl_module = Extension(name = "._" + MODULE_NAME,
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sources = [ join("src", MODULE_NAME + "_wrap.c") ],
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include_dirs = [numpy_includedir, QMCKL_INCLUDEDIR],
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#library_dirs = [QMCKL_LIBDIR],
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runtime_library_dirs = [QMCKL_LIBDIR],
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libraries = ["qmckl"],
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extra_compile_args = ["-Wall"],
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extra_link_args = ["-L" + QMCKL_LIBDIR],
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depends = [ join("src", "qmckl.h") ],
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language = "c"
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)
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setup(name = MODULE_NAME,
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version = "1.0.0",
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author = "TREX-CoE",
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author_email = "posenitskiy@irsamc.ups-tlse.fr",
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description = """Python API of the QMCkl library""",
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long_description = long_description,
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long_description_content_type = "text/markdown",
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ext_modules = [qmckl_module],
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py_modules = [MODULE_NAME],
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url = "https://github.com/TREX-CoE/qmckl",
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license = "BSD",
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classifiers=[
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"Intended Audience :: Science/Research",
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"Intended Audience :: Developers",
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"Topic :: Scientific/Engineering",
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"Programming Language :: C",
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"Programming Language :: Python",
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"Programming Language :: Python :: 3",
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"Programming Language :: Python :: 3 :: Only",
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"Programming Language :: Python :: Implementation :: CPython",
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"License :: OSI Approved :: BSD License",
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"Operating System :: POSIX",
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"Operating System :: Unix",
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"Operating System :: MacOS"
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],
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python_requires = ">=3.0",
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# The ABI incompatibility of numpy is a pain, for now set the
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# min numpy version such that we have wheels for CPython 3.5 & 3.6
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install_requires = ["numpy>=1.13.3"]
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)
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