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add requirements files (pip-compile)
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| Original file line number | Diff line number | Diff line change |
|---|---|---|
| @@ -0,0 +1,241 @@ | ||
| # | ||
| # This file is autogenerated by pip-compile with python 3.9 | ||
| # To update, run: | ||
| # | ||
| # pip-compile --all-extras --output-file=requirements-extras.txt | ||
| # | ||
| aflow==0.0.11 | ||
| # via matminer (setup.py) | ||
| ase==3.22.1 | ||
| # via | ||
| # aflow | ||
| # dscribe | ||
| # matminer (setup.py) | ||
| attrs==22.1.0 | ||
| # via jsonschema | ||
| beautifulsoup4==4.11.1 | ||
| # via aflow | ||
| certifi==2022.9.24 | ||
| # via requests | ||
| cffi==1.15.1 | ||
| # via cryptography | ||
| charset-normalizer==2.1.1 | ||
| # via requests | ||
| citrination-client==6.5.1 | ||
| # via matminer (setup.py) | ||
| contourpy==1.0.5 | ||
| # via matplotlib | ||
| cryptography==38.0.1 | ||
| # via | ||
| # globus-sdk | ||
| # pyjwt | ||
| cycler==0.11.0 | ||
| # via matplotlib | ||
| dnspython==2.2.1 | ||
| # via pymongo | ||
| dscribe==1.2.2 | ||
| # via matminer (setup.py) | ||
| emmet-core==0.38.6 | ||
| # via mp-api | ||
| fair-research-login==0.3.0 | ||
| # via mdf-toolbox | ||
| fonttools==4.38.0 | ||
| # via matplotlib | ||
| future==0.18.2 | ||
| # via | ||
| # matminer (setup.py) | ||
| # uncertainties | ||
| globus-nexus-client==0.4.1 | ||
| # via mdf-toolbox | ||
| globus-sdk==3.13.0 | ||
| # via | ||
| # fair-research-login | ||
| # globus-nexus-client | ||
| # mdf-forge | ||
| # mdf-toolbox | ||
| httplib2==0.20.4 | ||
| # via matminer (setup.py) | ||
| idna==3.4 | ||
| # via requests | ||
| jinja2==3.1.2 | ||
| # via aflow | ||
| jmespath==1.0.1 | ||
| # via matminer (setup.py) | ||
| joblib==1.2.0 | ||
| # via | ||
| # dscribe | ||
| # scikit-learn | ||
| jsonschema==4.3.0 | ||
| # via | ||
| # matminer (setup.py) | ||
| # mdf-toolbox | ||
| kiwisolver==1.4.4 | ||
| # via matplotlib | ||
| latexcodec==2.0.1 | ||
| # via pybtex | ||
| llvmlite==0.39.1 | ||
| # via numba | ||
| markupsafe==2.1.1 | ||
| # via jinja2 | ||
| matplotlib==3.6.1 | ||
| # via | ||
| # ase | ||
| # pymatgen | ||
| mdf-forge==0.8.0 | ||
| # via matminer (setup.py) | ||
| mdf-toolbox==0.6.0 | ||
| # via mdf-forge | ||
| monty==2022.9.9 | ||
| # via | ||
| # emmet-core | ||
| # matminer (setup.py) | ||
| # mp-api | ||
| # pymatgen | ||
| mp-api==0.29.3 | ||
| # via pymatgen | ||
| mpmath==1.2.1 | ||
| # via sympy | ||
| msgpack==1.0.4 | ||
| # via mp-api | ||
| networkx==2.8.7 | ||
| # via pymatgen | ||
| numba==0.56.3 | ||
| # via sparse | ||
| numpy==1.23.4 | ||
| # via | ||
| # aflow | ||
| # ase | ||
| # contourpy | ||
| # dscribe | ||
| # matminer (setup.py) | ||
| # matplotlib | ||
| # numba | ||
| # pandas | ||
| # pymatgen | ||
| # pypif | ||
| # scikit-learn | ||
| # scipy | ||
| # sparse | ||
| # spglib | ||
| packaging==21.3 | ||
| # via matplotlib | ||
| palettable==3.3.0 | ||
| # via pymatgen | ||
| pandas==1.5.1 | ||
| # via | ||
| # matminer (setup.py) | ||
| # pymatgen | ||
| pillow==9.2.0 | ||
| # via matplotlib | ||
| plotly==5.11.0 | ||
| # via pymatgen | ||
| pybind11==2.10.0 | ||
| # via dscribe | ||
| pybtex==0.24.0 | ||
| # via | ||
| # emmet-core | ||
| # pymatgen | ||
| pycparser==2.21 | ||
| # via cffi | ||
| pydantic==1.10.2 | ||
| # via emmet-core | ||
| pyjwt[crypto]==2.6.0 | ||
| # via globus-sdk | ||
| pymatgen==2022.10.22 | ||
| # via | ||
| # emmet-core | ||
| # matminer (setup.py) | ||
| # mp-api | ||
| pymongo==4.3.2 | ||
| # via matminer (setup.py) | ||
| pyparsing==3.0.9 | ||
| # via | ||
| # httplib2 | ||
| # matplotlib | ||
| # packaging | ||
| pypif==2.1.2 | ||
| # via citrination-client | ||
| pyrsistent==0.18.1 | ||
| # via jsonschema | ||
| python-dateutil==2.8.2 | ||
| # via | ||
| # matplotlib | ||
| # pandas | ||
| pytz==2022.5 | ||
| # via pandas | ||
| pyyaml==6.0 | ||
| # via | ||
| # citrination-client | ||
| # pybtex | ||
| requests==2.28.1 | ||
| # via | ||
| # citrination-client | ||
| # globus-sdk | ||
| # matminer (setup.py) | ||
| # mdf-forge | ||
| # mdf-toolbox | ||
| # mp-api | ||
| # pymatgen | ||
| ruamel-yaml==0.17.21 | ||
| # via pymatgen | ||
| ruamel-yaml-clib==0.2.7 | ||
| # via ruamel-yaml | ||
| scikit-learn==1.1.3 | ||
| # via | ||
| # dscribe | ||
| # matminer (setup.py) | ||
| scipy==1.9.3 | ||
| # via | ||
| # ase | ||
| # dscribe | ||
| # pymatgen | ||
| # scikit-learn | ||
| # sparse | ||
| six==1.16.0 | ||
| # via | ||
| # aflow | ||
| # citrination-client | ||
| # latexcodec | ||
| # pybtex | ||
| # pypif | ||
| # python-dateutil | ||
| soupsieve==2.3.2.post1 | ||
| # via beautifulsoup4 | ||
| sparse==0.13.0 | ||
| # via dscribe | ||
| spglib==2.0.1 | ||
| # via | ||
| # emmet-core | ||
| # pymatgen | ||
| sympy==1.11.1 | ||
| # via | ||
| # matminer (setup.py) | ||
| # pymatgen | ||
| tabulate==0.9.0 | ||
| # via pymatgen | ||
| tenacity==8.1.0 | ||
| # via plotly | ||
| termcolor==2.0.1 | ||
| # via aflow | ||
| threadpoolctl==3.1.0 | ||
| # via scikit-learn | ||
| tqdm==4.64.1 | ||
| # via | ||
| # matminer (setup.py) | ||
| # mdf-forge | ||
| # pymatgen | ||
| typing-extensions==4.4.0 | ||
| # via | ||
| # emmet-core | ||
| # globus-sdk | ||
| # mp-api | ||
| # pydantic | ||
| ujson==5.5.0 | ||
| # via matminer (setup.py) | ||
| uncertainties==3.1.7 | ||
| # via pymatgen | ||
| urllib3==1.26.12 | ||
| # via requests | ||
|
|
||
| # The following packages are considered to be unsafe in a requirements file: | ||
| # setuptools |
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| Original file line number | Diff line number | Diff line change |
|---|---|---|
| @@ -0,0 +1,151 @@ | ||
| # | ||
| # This file is autogenerated by pip-compile with python 3.9 | ||
| # To update, run: | ||
| # | ||
| # pip-compile | ||
| # | ||
| attrs==22.1.0 | ||
| # via jsonschema | ||
| certifi==2022.9.24 | ||
| # via requests | ||
| charset-normalizer==2.1.1 | ||
| # via requests | ||
| contourpy==1.0.5 | ||
| # via matplotlib | ||
| cycler==0.11.0 | ||
| # via matplotlib | ||
| dnspython==2.2.1 | ||
| # via pymongo | ||
| emmet-core==0.38.6 | ||
| # via mp-api | ||
| fonttools==4.38.0 | ||
| # via matplotlib | ||
| future==0.18.2 | ||
| # via | ||
| # matminer (setup.py) | ||
| # uncertainties | ||
| idna==3.4 | ||
| # via requests | ||
| joblib==1.2.0 | ||
| # via scikit-learn | ||
| jsonschema==4.16.0 | ||
| # via matminer (setup.py) | ||
| kiwisolver==1.4.4 | ||
| # via matplotlib | ||
| latexcodec==2.0.1 | ||
| # via pybtex | ||
| matplotlib==3.6.1 | ||
| # via pymatgen | ||
| monty==2022.9.9 | ||
| # via | ||
| # emmet-core | ||
| # matminer (setup.py) | ||
| # mp-api | ||
| # pymatgen | ||
| mp-api==0.29.3 | ||
| # via pymatgen | ||
| mpmath==1.2.1 | ||
| # via sympy | ||
| msgpack==1.0.4 | ||
| # via mp-api | ||
| networkx==2.8.7 | ||
| # via pymatgen | ||
| numpy==1.23.4 | ||
| # via | ||
| # contourpy | ||
| # matminer (setup.py) | ||
| # matplotlib | ||
| # pandas | ||
| # pymatgen | ||
| # scikit-learn | ||
| # scipy | ||
| # spglib | ||
| packaging==21.3 | ||
| # via matplotlib | ||
| palettable==3.3.0 | ||
| # via pymatgen | ||
| pandas==1.5.1 | ||
| # via | ||
| # matminer (setup.py) | ||
| # pymatgen | ||
| pillow==9.2.0 | ||
| # via matplotlib | ||
| plotly==5.11.0 | ||
| # via pymatgen | ||
| pybtex==0.24.0 | ||
| # via | ||
| # emmet-core | ||
| # pymatgen | ||
| pydantic==1.10.2 | ||
| # via emmet-core | ||
| pymatgen==2022.10.22 | ||
| # via | ||
| # emmet-core | ||
| # matminer (setup.py) | ||
| # mp-api | ||
| pymongo==4.3.2 | ||
| # via matminer (setup.py) | ||
| pyparsing==3.0.9 | ||
| # via | ||
| # matplotlib | ||
| # packaging | ||
| pyrsistent==0.18.1 | ||
| # via jsonschema | ||
| python-dateutil==2.8.2 | ||
| # via | ||
| # matplotlib | ||
| # pandas | ||
| pytz==2022.5 | ||
| # via pandas | ||
| pyyaml==6.0 | ||
| # via pybtex | ||
| requests==2.28.1 | ||
| # via | ||
| # matminer (setup.py) | ||
| # mp-api | ||
| # pymatgen | ||
| ruamel-yaml==0.17.21 | ||
| # via pymatgen | ||
| ruamel-yaml-clib==0.2.7 | ||
| # via ruamel-yaml | ||
| scikit-learn==1.1.3 | ||
| # via matminer (setup.py) | ||
| scipy==1.9.3 | ||
| # via | ||
| # pymatgen | ||
| # scikit-learn | ||
| six==1.16.0 | ||
| # via | ||
| # latexcodec | ||
| # pybtex | ||
| # python-dateutil | ||
| spglib==2.0.1 | ||
| # via | ||
| # emmet-core | ||
| # pymatgen | ||
| sympy==1.11.1 | ||
| # via | ||
| # matminer (setup.py) | ||
| # pymatgen | ||
| tabulate==0.9.0 | ||
| # via pymatgen | ||
| tenacity==8.1.0 | ||
| # via plotly | ||
| threadpoolctl==3.1.0 | ||
| # via scikit-learn | ||
| tqdm==4.64.1 | ||
| # via | ||
| # matminer (setup.py) | ||
| # pymatgen | ||
| typing-extensions==4.4.0 | ||
| # via | ||
| # emmet-core | ||
| # mp-api | ||
| # pydantic | ||
| uncertainties==3.1.7 | ||
| # via pymatgen | ||
| urllib3==1.26.12 | ||
| # via requests | ||
|
|
||
| # The following packages are considered to be unsafe in a requirements file: | ||
| # setuptools |