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build_ext.py
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build_ext.py
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"""
Created on August 7, 2021 by Andrew Abi-Mansour
This is the::
_ _ _ _____ ___ __ __ _ ____ _____ ___ _ _ ___
/ \ | | | |_ _/ _ \ | \/ | / \ | _ \_ _|_ _| \ | |_ _|
/ _ \| | | | | || | | | | |\/| | / _ \ | |_) || | | || \| || |
/ ___ \ |_| | | || |_| | | | | |/ ___ \| _ < | | | || |\ || |
/_/ \_\___/ |_| \___/ |_| |_/_/ \_\_| \_\|_| |___|_| \_|___|
Tool for automatic MARTINI mapping and parametrization of small organic molecules
Developers::
Tristan BEREAU (bereau at mpip-mainz.mpg.de)
Kiran Kanekal (kanekal at mpip-mainz.mpg.de)
Andrew Abi-Mansour (andrew.gaam at gmail.com)
AUTO_MARTINI is open-source, distributed under the terms of the GNU Public
License, version 2 or later. It is distributed in the hope that it will
be useful, but WITHOUT ANY WARRANTY; without even the implied warranty
of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. You should have
received a copy of the GNU General Public License along with PyGran.
If not, see http://www.gnu.org/licenses . See also top-level README
and LICENSE files.
"""
import numpy
from Cython.Build import cythonize
def build(setup_kwargs):
setup_kwargs.update(
ext_modules=cythonize(["auto_martini/optimization.pyx"]),
include_dirs=numpy.get_include(),
)