From ff38fea5b8f385193e0a9a31012dd7274ab320fa Mon Sep 17 00:00:00 2001 From: Patrick Huck Date: Wed, 9 Nov 2022 14:27:09 -0800 Subject: [PATCH] Automated dependency upgrades (#884) * update dependencies for macos-latest/py3.10 * update dependencies for macos-latest/py3.8 * update dependencies for macos-latest/py3.9 * update dependencies for ubuntu-latest/py3.10 * update dependencies for ubuntu-latest/py3.8 * update dependencies for ubuntu-latest/py3.9 Co-authored-by: github-actions --- requirements/macos-latest_py3.10.txt | 145 +++++++++ requirements/macos-latest_py3.10_extras.txt | 308 ++++++++++++++++++ requirements/macos-latest_py3.8.txt | 145 +++++++++ requirements/macos-latest_py3.8_extras.txt | 320 +++++++++++++++++++ requirements/macos-latest_py3.9.txt | 20 +- requirements/macos-latest_py3.9_extras.txt | 312 ++++++++++++++++++ requirements/ubuntu-latest_py3.10.txt | 145 +++++++++ requirements/ubuntu-latest_py3.10_extras.txt | 308 ++++++++++++++++++ requirements/ubuntu-latest_py3.8.txt | 145 +++++++++ requirements/ubuntu-latest_py3.8_extras.txt | 320 +++++++++++++++++++ requirements/ubuntu-latest_py3.9.txt | 145 +++++++++ requirements/ubuntu-latest_py3.9_extras.txt | 312 ++++++++++++++++++ 12 files changed, 2615 insertions(+), 10 deletions(-) create mode 100644 requirements/macos-latest_py3.10.txt create mode 100644 requirements/macos-latest_py3.10_extras.txt create mode 100644 requirements/macos-latest_py3.8.txt create mode 100644 requirements/macos-latest_py3.8_extras.txt create mode 100644 requirements/macos-latest_py3.9_extras.txt create mode 100644 requirements/ubuntu-latest_py3.10.txt create mode 100644 requirements/ubuntu-latest_py3.10_extras.txt create mode 100644 requirements/ubuntu-latest_py3.8.txt create mode 100644 requirements/ubuntu-latest_py3.8_extras.txt create mode 100644 requirements/ubuntu-latest_py3.9.txt create mode 100644 requirements/ubuntu-latest_py3.9_extras.txt diff --git a/requirements/macos-latest_py3.10.txt b/requirements/macos-latest_py3.10.txt new file mode 100644 index 000000000..6621f12f3 --- /dev/null +++ b/requirements/macos-latest_py3.10.txt @@ -0,0 +1,145 @@ +# +# This file is autogenerated by pip-compile with python 3.10 +# To update, run: +# +# pip-compile --output-file=requirements/macos-latest_py3.10.txt +# +certifi==2022.9.24 + # via requests +charset-normalizer==2.1.1 + # via requests +contourpy==1.0.6 + # via matplotlib +cycler==0.11.0 + # via matplotlib +dnspython==2.2.1 + # via pymongo +emmet-core==0.38.9 + # 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 +kiwisolver==1.4.4 + # via matplotlib +latexcodec==2.0.1 + # via pybtex +matplotlib==3.6.2 + # via pymatgen +monty==2022.9.9 + # via + # emmet-core + # matminer (setup.py) + # mp-api + # pymatgen +mp-api==0.29.4 + # via pymatgen +mpmath==1.2.1 + # via sympy +msgpack==1.0.4 + # via mp-api +networkx==2.8.8 + # 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==9.3.0 + # via matplotlib +plotly==5.11.0 + # via pymatgen +pybtex==0.24.0 + # via + # emmet-core + # pymatgen +pydantic==1.10.2 + # via emmet-core +pymatgen==2022.11.7 + # via + # emmet-core + # matminer (setup.py) + # mp-api +pymongo==4.3.2 + # via matminer (setup.py) +pyparsing==3.0.9 + # via + # matplotlib + # packaging +python-dateutil==2.8.2 + # via + # matplotlib + # pandas +pytz==2022.6 + # 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==2.0.2 + # 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 diff --git a/requirements/macos-latest_py3.10_extras.txt b/requirements/macos-latest_py3.10_extras.txt new file mode 100644 index 000000000..8c9df4367 --- /dev/null +++ b/requirements/macos-latest_py3.10_extras.txt @@ -0,0 +1,308 @@ +# +# This file is autogenerated by pip-compile with python 3.10 +# To update, run: +# +# pip-compile --all-extras --output-file=requirements/macos-latest_py3.10_extras.txt +# +aflow==0.0.11 + # via matminer (setup.py) +ase==3.22.1 + # via + # aflow + # dscribe + # matminer (setup.py) +astroid==2.12.12 + # via pylint +attrs==22.1.0 + # via + # jsonschema + # pytest +beautifulsoup4==4.11.1 + # via aflow +black==22.10.0 + # via matminer (setup.py) +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) +click==8.1.3 + # via black +contourpy==1.0.6 + # via matplotlib +coverage[toml]==6.5.0 + # via + # coveralls + # matminer (setup.py) + # pytest-cov +coveralls==3.3.1 + # via matminer (setup.py) +cryptography==38.0.3 + # via + # globus-sdk + # pyjwt +cycler==0.11.0 + # via matplotlib +dill==0.3.6 + # via pylint +dnspython==2.2.1 + # via pymongo +docopt==0.6.2 + # via coveralls +dscribe==1.2.2 + # via matminer (setup.py) +emmet-core==0.38.9 + # via mp-api +exceptiongroup==1.0.1 + # via pytest +fair-research-login==0.3.0 + # via mdf-toolbox +flake8==5.0.4 + # via matminer (setup.py) +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==3.14.0 + # via + # fair-research-login + # globus-nexus-client + # mdf-forge + # mdf-toolbox +httplib2==0.21.0 + # via matminer (setup.py) +idna==3.4 + # via requests +iniconfig==1.1.1 + # via pytest +isort==5.10.1 + # via pylint +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 +lazy-object-proxy==1.8.0 + # via astroid +llvmlite==0.39.1 + # via numba +markupsafe==2.1.1 + # via jinja2 +matplotlib==3.6.2 + # via + # ase + # pymatgen +mccabe==0.7.0 + # via + # flake8 + # pylint +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==0.29.4 + # via pymatgen +mpmath==1.2.1 + # via sympy +msgpack==1.0.4 + # via mp-api +mypy-extensions==0.4.3 + # via black +networkx==2.8.8 + # via pymatgen +numba==0.56.4 + # 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 + # pytest +palettable==3.3.0 + # via pymatgen +pandas==1.5.1 + # via + # matminer (setup.py) + # pymatgen +pathspec==0.10.1 + # via black +pillow==9.3.0 + # via matplotlib +platformdirs==2.5.3 + # via + # black + # pylint +plotly==5.11.0 + # via pymatgen +pluggy==1.0.0 + # via pytest +pybind11==2.10.1 + # via dscribe +pybtex==0.24.0 + # via + # emmet-core + # pymatgen +pycodestyle==2.9.1 + # via flake8 +pycparser==2.21 + # via cffi +pydantic==1.10.2 + # via emmet-core +pyflakes==2.5.0 + # via flake8 +pyjwt[crypto]==2.6.0 + # via globus-sdk +pylint==2.15.5 + # via matminer (setup.py) +pymatgen==2022.11.7 + # 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==0.19.2 + # via jsonschema +pytest==7.2.0 + # via + # matminer (setup.py) + # pytest-cov +pytest-cov==4.0.0 + # via matminer (setup.py) +python-dateutil==2.8.2 + # via + # matplotlib + # pandas +pytz==2022.6 + # via pandas +pyyaml==6.0 + # via + # citrination-client + # pybtex +requests==2.28.1 + # via + # citrination-client + # coveralls + # 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==2.0.2 + # 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==2.1.0 + # via aflow +threadpoolctl==3.1.0 + # via scikit-learn +tomli==2.0.1 + # via + # black + # coverage + # pylint + # pytest +tomlkit==0.11.6 + # via pylint +tqdm==4.64.1 + # via + # matminer (setup.py) + # mdf-forge + # pymatgen +typing-extensions==4.4.0 + # via + # emmet-core + # mp-api + # pydantic +ujson==5.5.0 + # via matminer (setup.py) +uncertainties==3.1.7 + # via pymatgen +urllib3==1.26.12 + # via requests +wrapt==1.14.1 + # via astroid + +# The following packages are considered to be unsafe in a requirements file: +# setuptools diff --git a/requirements/macos-latest_py3.8.txt b/requirements/macos-latest_py3.8.txt new file mode 100644 index 000000000..b2144847a --- /dev/null +++ b/requirements/macos-latest_py3.8.txt @@ -0,0 +1,145 @@ +# +# This file is autogenerated by pip-compile with python 3.8 +# To update, run: +# +# pip-compile --output-file=requirements/macos-latest_py3.8.txt +# +certifi==2022.9.24 + # via requests +charset-normalizer==2.1.1 + # via requests +contourpy==1.0.6 + # via matplotlib +cycler==0.11.0 + # via matplotlib +dnspython==2.2.1 + # via pymongo +emmet-core==0.38.9 + # 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 +kiwisolver==1.4.4 + # via matplotlib +latexcodec==2.0.1 + # via pybtex +matplotlib==3.6.2 + # via pymatgen +monty==2022.9.9 + # via + # emmet-core + # matminer (setup.py) + # mp-api + # pymatgen +mp-api==0.29.4 + # via pymatgen +mpmath==1.2.1 + # via sympy +msgpack==1.0.4 + # via mp-api +networkx==2.8.8 + # 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==9.3.0 + # via matplotlib +plotly==5.11.0 + # via pymatgen +pybtex==0.24.0 + # via + # emmet-core + # pymatgen +pydantic==1.10.2 + # via emmet-core +pymatgen==2022.11.7 + # via + # emmet-core + # matminer (setup.py) + # mp-api +pymongo==4.3.2 + # via matminer (setup.py) +pyparsing==3.0.9 + # via + # matplotlib + # packaging +python-dateutil==2.8.2 + # via + # matplotlib + # pandas +pytz==2022.6 + # 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==2.0.2 + # 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 diff --git a/requirements/macos-latest_py3.8_extras.txt b/requirements/macos-latest_py3.8_extras.txt new file mode 100644 index 000000000..b1e3e5e16 --- /dev/null +++ b/requirements/macos-latest_py3.8_extras.txt @@ -0,0 +1,320 @@ +# +# This file is autogenerated by pip-compile with python 3.8 +# To update, run: +# +# pip-compile --all-extras --output-file=requirements/macos-latest_py3.8_extras.txt +# +aflow==0.0.11 + # via matminer (setup.py) +ase==3.22.1 + # via + # aflow + # dscribe + # matminer (setup.py) +astroid==2.12.12 + # via pylint +attrs==22.1.0 + # via + # jsonschema + # pytest +beautifulsoup4==4.11.1 + # via aflow +black==22.10.0 + # via matminer (setup.py) +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) +click==8.1.3 + # via black +contourpy==1.0.6 + # via matplotlib +coverage[toml]==6.5.0 + # via + # coveralls + # matminer (setup.py) + # pytest-cov +coveralls==3.3.1 + # via matminer (setup.py) +cryptography==38.0.3 + # via + # globus-sdk + # pyjwt +cycler==0.11.0 + # via matplotlib +dill==0.3.6 + # via pylint +dnspython==2.2.1 + # via pymongo +docopt==0.6.2 + # via coveralls +dscribe==1.2.2 + # via matminer (setup.py) +emmet-core==0.38.9 + # via mp-api +exceptiongroup==1.0.1 + # via pytest +fair-research-login==0.3.0 + # via mdf-toolbox +flake8==5.0.4 + # via matminer (setup.py) +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==3.14.0 + # via + # fair-research-login + # globus-nexus-client + # mdf-forge + # mdf-toolbox +httplib2==0.21.0 + # via matminer (setup.py) +idna==3.4 + # via requests +importlib-metadata==5.0.0 + # via numba +importlib-resources==5.10.0 + # via jsonschema +iniconfig==1.1.1 + # via pytest +isort==5.10.1 + # via pylint +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 +lazy-object-proxy==1.8.0 + # via astroid +llvmlite==0.39.1 + # via numba +markupsafe==2.1.1 + # via jinja2 +matplotlib==3.6.2 + # via + # ase + # pymatgen +mccabe==0.7.0 + # via + # flake8 + # pylint +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==0.29.4 + # via pymatgen +mpmath==1.2.1 + # via sympy +msgpack==1.0.4 + # via mp-api +mypy-extensions==0.4.3 + # via black +networkx==2.8.8 + # via pymatgen +numba==0.56.4 + # 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 + # pytest +palettable==3.3.0 + # via pymatgen +pandas==1.5.1 + # via + # matminer (setup.py) + # pymatgen +pathspec==0.10.1 + # via black +pillow==9.3.0 + # via matplotlib +platformdirs==2.5.3 + # via + # black + # pylint +plotly==5.11.0 + # via pymatgen +pluggy==1.0.0 + # via pytest +pybind11==2.10.1 + # via dscribe +pybtex==0.24.0 + # via + # emmet-core + # pymatgen +pycodestyle==2.9.1 + # via flake8 +pycparser==2.21 + # via cffi +pydantic==1.10.2 + # via emmet-core +pyflakes==2.5.0 + # via flake8 +pyjwt[crypto]==2.6.0 + # via globus-sdk +pylint==2.15.5 + # via matminer (setup.py) +pymatgen==2022.11.7 + # 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==0.19.2 + # via jsonschema +pytest==7.2.0 + # via + # matminer (setup.py) + # pytest-cov +pytest-cov==4.0.0 + # via matminer (setup.py) +python-dateutil==2.8.2 + # via + # matplotlib + # pandas +pytz==2022.6 + # via pandas +pyyaml==6.0 + # via + # citrination-client + # pybtex +requests==2.28.1 + # via + # citrination-client + # coveralls + # 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==2.0.2 + # 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==2.1.0 + # via aflow +threadpoolctl==3.1.0 + # via scikit-learn +tomli==2.0.1 + # via + # black + # coverage + # pylint + # pytest +tomlkit==0.11.6 + # via pylint +tqdm==4.64.1 + # via + # matminer (setup.py) + # mdf-forge + # pymatgen +typing-extensions==4.4.0 + # via + # astroid + # black + # emmet-core + # globus-sdk + # mp-api + # pydantic + # pylint +ujson==5.5.0 + # via matminer (setup.py) +uncertainties==3.1.7 + # via pymatgen +urllib3==1.26.12 + # via requests +wrapt==1.14.1 + # via astroid +zipp==3.10.0 + # via + # importlib-metadata + # importlib-resources + +# The following packages are considered to be unsafe in a requirements file: +# setuptools diff --git a/requirements/macos-latest_py3.9.txt b/requirements/macos-latest_py3.9.txt index ef14ae694..340837c86 100644 --- a/requirements/macos-latest_py3.9.txt +++ b/requirements/macos-latest_py3.9.txt @@ -2,19 +2,19 @@ # This file is autogenerated by pip-compile with python 3.9 # To update, run: # -# pip-compile +# pip-compile --output-file=requirements/macos-latest_py3.9.txt # certifi==2022.9.24 # via requests charset-normalizer==2.1.1 # via requests -contourpy==1.0.5 +contourpy==1.0.6 # via matplotlib cycler==0.11.0 # via matplotlib dnspython==2.2.1 # via pymongo -emmet-core==0.38.6 +emmet-core==0.38.9 # via mp-api fonttools==4.38.0 # via matplotlib @@ -30,7 +30,7 @@ kiwisolver==1.4.4 # via matplotlib latexcodec==2.0.1 # via pybtex -matplotlib==3.6.1 +matplotlib==3.6.2 # via pymatgen monty==2022.9.9 # via @@ -38,13 +38,13 @@ monty==2022.9.9 # matminer (setup.py) # mp-api # pymatgen -mp-api==0.29.3 +mp-api==0.29.4 # via pymatgen mpmath==1.2.1 # via sympy msgpack==1.0.4 # via mp-api -networkx==2.8.7 +networkx==2.8.8 # via pymatgen numpy==1.23.4 # via @@ -64,7 +64,7 @@ pandas==1.5.1 # via # matminer (setup.py) # pymatgen -pillow==9.2.0 +pillow==9.3.0 # via matplotlib plotly==5.11.0 # via pymatgen @@ -74,7 +74,7 @@ pybtex==0.24.0 # pymatgen pydantic==1.10.2 # via emmet-core -pymatgen==2022.10.22 +pymatgen==2022.11.7 # via # emmet-core # matminer (setup.py) @@ -89,7 +89,7 @@ python-dateutil==2.8.2 # via # matplotlib # pandas -pytz==2022.5 +pytz==2022.6 # via pandas pyyaml==6.0 # via pybtex @@ -113,7 +113,7 @@ six==1.16.0 # latexcodec # pybtex # python-dateutil -spglib==2.0.1 +spglib==2.0.2 # via # emmet-core # pymatgen diff --git a/requirements/macos-latest_py3.9_extras.txt b/requirements/macos-latest_py3.9_extras.txt new file mode 100644 index 000000000..628777096 --- /dev/null +++ b/requirements/macos-latest_py3.9_extras.txt @@ -0,0 +1,312 @@ +# +# This file is autogenerated by pip-compile with python 3.9 +# To update, run: +# +# pip-compile --all-extras --output-file=requirements/macos-latest_py3.9_extras.txt +# +aflow==0.0.11 + # via matminer (setup.py) +ase==3.22.1 + # via + # aflow + # dscribe + # matminer (setup.py) +astroid==2.12.12 + # via pylint +attrs==22.1.0 + # via + # jsonschema + # pytest +beautifulsoup4==4.11.1 + # via aflow +black==22.10.0 + # via matminer (setup.py) +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) +click==8.1.3 + # via black +contourpy==1.0.6 + # via matplotlib +coverage[toml]==6.5.0 + # via + # coveralls + # matminer (setup.py) + # pytest-cov +coveralls==3.3.1 + # via matminer (setup.py) +cryptography==38.0.3 + # via + # globus-sdk + # pyjwt +cycler==0.11.0 + # via matplotlib +dill==0.3.6 + # via pylint +dnspython==2.2.1 + # via pymongo +docopt==0.6.2 + # via coveralls +dscribe==1.2.2 + # via matminer (setup.py) +emmet-core==0.38.9 + # via mp-api +exceptiongroup==1.0.1 + # via pytest +fair-research-login==0.3.0 + # via mdf-toolbox +flake8==5.0.4 + # via matminer (setup.py) +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==3.14.0 + # via + # fair-research-login + # globus-nexus-client + # mdf-forge + # mdf-toolbox +httplib2==0.21.0 + # via matminer (setup.py) +idna==3.4 + # via requests +iniconfig==1.1.1 + # via pytest +isort==5.10.1 + # via pylint +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 +lazy-object-proxy==1.8.0 + # via astroid +llvmlite==0.39.1 + # via numba +markupsafe==2.1.1 + # via jinja2 +matplotlib==3.6.2 + # via + # ase + # pymatgen +mccabe==0.7.0 + # via + # flake8 + # pylint +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==0.29.4 + # via pymatgen +mpmath==1.2.1 + # via sympy +msgpack==1.0.4 + # via mp-api +mypy-extensions==0.4.3 + # via black +networkx==2.8.8 + # via pymatgen +numba==0.56.4 + # 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 + # pytest +palettable==3.3.0 + # via pymatgen +pandas==1.5.1 + # via + # matminer (setup.py) + # pymatgen +pathspec==0.10.1 + # via black +pillow==9.3.0 + # via matplotlib +platformdirs==2.5.3 + # via + # black + # pylint +plotly==5.11.0 + # via pymatgen +pluggy==1.0.0 + # via pytest +pybind11==2.10.1 + # via dscribe +pybtex==0.24.0 + # via + # emmet-core + # pymatgen +pycodestyle==2.9.1 + # via flake8 +pycparser==2.21 + # via cffi +pydantic==1.10.2 + # via emmet-core +pyflakes==2.5.0 + # via flake8 +pyjwt[crypto]==2.6.0 + # via globus-sdk +pylint==2.15.5 + # via matminer (setup.py) +pymatgen==2022.11.7 + # 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==0.19.2 + # via jsonschema +pytest==7.2.0 + # via + # matminer (setup.py) + # pytest-cov +pytest-cov==4.0.0 + # via matminer (setup.py) +python-dateutil==2.8.2 + # via + # matplotlib + # pandas +pytz==2022.6 + # via pandas +pyyaml==6.0 + # via + # citrination-client + # pybtex +requests==2.28.1 + # via + # citrination-client + # coveralls + # 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==2.0.2 + # 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==2.1.0 + # via aflow +threadpoolctl==3.1.0 + # via scikit-learn +tomli==2.0.1 + # via + # black + # coverage + # pylint + # pytest +tomlkit==0.11.6 + # via pylint +tqdm==4.64.1 + # via + # matminer (setup.py) + # mdf-forge + # pymatgen +typing-extensions==4.4.0 + # via + # astroid + # black + # emmet-core + # globus-sdk + # mp-api + # pydantic + # pylint +ujson==5.5.0 + # via matminer (setup.py) +uncertainties==3.1.7 + # via pymatgen +urllib3==1.26.12 + # via requests +wrapt==1.14.1 + # via astroid + +# The following packages are considered to be unsafe in a requirements file: +# setuptools diff --git a/requirements/ubuntu-latest_py3.10.txt b/requirements/ubuntu-latest_py3.10.txt new file mode 100644 index 000000000..b6752b9d0 --- /dev/null +++ b/requirements/ubuntu-latest_py3.10.txt @@ -0,0 +1,145 @@ +# +# This file is autogenerated by pip-compile with python 3.10 +# To update, run: +# +# pip-compile --output-file=requirements/ubuntu-latest_py3.10.txt +# +certifi==2022.9.24 + # via requests +charset-normalizer==2.1.1 + # via requests +contourpy==1.0.6 + # via matplotlib +cycler==0.11.0 + # via matplotlib +dnspython==2.2.1 + # via pymongo +emmet-core==0.38.9 + # 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 +kiwisolver==1.4.4 + # via matplotlib +latexcodec==2.0.1 + # via pybtex +matplotlib==3.6.2 + # via pymatgen +monty==2022.9.9 + # via + # emmet-core + # matminer (setup.py) + # mp-api + # pymatgen +mp-api==0.29.4 + # via pymatgen +mpmath==1.2.1 + # via sympy +msgpack==1.0.4 + # via mp-api +networkx==2.8.8 + # 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==9.3.0 + # via matplotlib +plotly==5.11.0 + # via pymatgen +pybtex==0.24.0 + # via + # emmet-core + # pymatgen +pydantic==1.10.2 + # via emmet-core +pymatgen==2022.11.7 + # via + # emmet-core + # matminer (setup.py) + # mp-api +pymongo==4.3.2 + # via matminer (setup.py) +pyparsing==3.0.9 + # via + # matplotlib + # packaging +python-dateutil==2.8.2 + # via + # matplotlib + # pandas +pytz==2022.6 + # 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==2.0.2 + # 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 diff --git a/requirements/ubuntu-latest_py3.10_extras.txt b/requirements/ubuntu-latest_py3.10_extras.txt new file mode 100644 index 000000000..a21940eff --- /dev/null +++ b/requirements/ubuntu-latest_py3.10_extras.txt @@ -0,0 +1,308 @@ +# +# This file is autogenerated by pip-compile with python 3.10 +# To update, run: +# +# pip-compile --all-extras --output-file=requirements/ubuntu-latest_py3.10_extras.txt +# +aflow==0.0.11 + # via matminer (setup.py) +ase==3.22.1 + # via + # aflow + # dscribe + # matminer (setup.py) +astroid==2.12.12 + # via pylint +attrs==22.1.0 + # via + # jsonschema + # pytest +beautifulsoup4==4.11.1 + # via aflow +black==22.10.0 + # via matminer (setup.py) +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) +click==8.1.3 + # via black +contourpy==1.0.6 + # via matplotlib +coverage[toml]==6.5.0 + # via + # coveralls + # matminer (setup.py) + # pytest-cov +coveralls==3.3.1 + # via matminer (setup.py) +cryptography==38.0.3 + # via + # globus-sdk + # pyjwt +cycler==0.11.0 + # via matplotlib +dill==0.3.6 + # via pylint +dnspython==2.2.1 + # via pymongo +docopt==0.6.2 + # via coveralls +dscribe==1.2.2 + # via matminer (setup.py) +emmet-core==0.38.9 + # via mp-api +exceptiongroup==1.0.1 + # via pytest +fair-research-login==0.3.0 + # via mdf-toolbox +flake8==5.0.4 + # via matminer (setup.py) +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==3.14.0 + # via + # fair-research-login + # globus-nexus-client + # mdf-forge + # mdf-toolbox +httplib2==0.21.0 + # via matminer (setup.py) +idna==3.4 + # via requests +iniconfig==1.1.1 + # via pytest +isort==5.10.1 + # via pylint +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 +lazy-object-proxy==1.8.0 + # via astroid +llvmlite==0.39.1 + # via numba +markupsafe==2.1.1 + # via jinja2 +matplotlib==3.6.2 + # via + # ase + # pymatgen +mccabe==0.7.0 + # via + # flake8 + # pylint +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==0.29.4 + # via pymatgen +mpmath==1.2.1 + # via sympy +msgpack==1.0.4 + # via mp-api +mypy-extensions==0.4.3 + # via black +networkx==2.8.8 + # via pymatgen +numba==0.56.4 + # 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 + # pytest +palettable==3.3.0 + # via pymatgen +pandas==1.5.1 + # via + # matminer (setup.py) + # pymatgen +pathspec==0.10.1 + # via black +pillow==9.3.0 + # via matplotlib +platformdirs==2.5.3 + # via + # black + # pylint +plotly==5.11.0 + # via pymatgen +pluggy==1.0.0 + # via pytest +pybind11==2.10.1 + # via dscribe +pybtex==0.24.0 + # via + # emmet-core + # pymatgen +pycodestyle==2.9.1 + # via flake8 +pycparser==2.21 + # via cffi +pydantic==1.10.2 + # via emmet-core +pyflakes==2.5.0 + # via flake8 +pyjwt[crypto]==2.6.0 + # via globus-sdk +pylint==2.15.5 + # via matminer (setup.py) +pymatgen==2022.11.7 + # 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==0.19.2 + # via jsonschema +pytest==7.2.0 + # via + # matminer (setup.py) + # pytest-cov +pytest-cov==4.0.0 + # via matminer (setup.py) +python-dateutil==2.8.2 + # via + # matplotlib + # pandas +pytz==2022.6 + # via pandas +pyyaml==6.0 + # via + # citrination-client + # pybtex +requests==2.28.1 + # via + # citrination-client + # coveralls + # 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==2.0.2 + # 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==2.1.0 + # via aflow +threadpoolctl==3.1.0 + # via scikit-learn +tomli==2.0.1 + # via + # black + # coverage + # pylint + # pytest +tomlkit==0.11.6 + # via pylint +tqdm==4.64.1 + # via + # matminer (setup.py) + # mdf-forge + # pymatgen +typing-extensions==4.4.0 + # via + # emmet-core + # mp-api + # pydantic +ujson==5.5.0 + # via matminer (setup.py) +uncertainties==3.1.7 + # via pymatgen +urllib3==1.26.12 + # via requests +wrapt==1.14.1 + # via astroid + +# The following packages are considered to be unsafe in a requirements file: +# setuptools diff --git a/requirements/ubuntu-latest_py3.8.txt b/requirements/ubuntu-latest_py3.8.txt new file mode 100644 index 000000000..8ebf85558 --- /dev/null +++ b/requirements/ubuntu-latest_py3.8.txt @@ -0,0 +1,145 @@ +# +# This file is autogenerated by pip-compile with python 3.8 +# To update, run: +# +# pip-compile --output-file=requirements/ubuntu-latest_py3.8.txt +# +certifi==2022.9.24 + # via requests +charset-normalizer==2.1.1 + # via requests +contourpy==1.0.6 + # via matplotlib +cycler==0.11.0 + # via matplotlib +dnspython==2.2.1 + # via pymongo +emmet-core==0.38.9 + # 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 +kiwisolver==1.4.4 + # via matplotlib +latexcodec==2.0.1 + # via pybtex +matplotlib==3.6.2 + # via pymatgen +monty==2022.9.9 + # via + # emmet-core + # matminer (setup.py) + # mp-api + # pymatgen +mp-api==0.29.4 + # via pymatgen +mpmath==1.2.1 + # via sympy +msgpack==1.0.4 + # via mp-api +networkx==2.8.8 + # 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==9.3.0 + # via matplotlib +plotly==5.11.0 + # via pymatgen +pybtex==0.24.0 + # via + # emmet-core + # pymatgen +pydantic==1.10.2 + # via emmet-core +pymatgen==2022.11.7 + # via + # emmet-core + # matminer (setup.py) + # mp-api +pymongo==4.3.2 + # via matminer (setup.py) +pyparsing==3.0.9 + # via + # matplotlib + # packaging +python-dateutil==2.8.2 + # via + # matplotlib + # pandas +pytz==2022.6 + # 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==2.0.2 + # 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 diff --git a/requirements/ubuntu-latest_py3.8_extras.txt b/requirements/ubuntu-latest_py3.8_extras.txt new file mode 100644 index 000000000..4f4b122b4 --- /dev/null +++ b/requirements/ubuntu-latest_py3.8_extras.txt @@ -0,0 +1,320 @@ +# +# This file is autogenerated by pip-compile with python 3.8 +# To update, run: +# +# pip-compile --all-extras --output-file=requirements/ubuntu-latest_py3.8_extras.txt +# +aflow==0.0.11 + # via matminer (setup.py) +ase==3.22.1 + # via + # aflow + # dscribe + # matminer (setup.py) +astroid==2.12.12 + # via pylint +attrs==22.1.0 + # via + # jsonschema + # pytest +beautifulsoup4==4.11.1 + # via aflow +black==22.10.0 + # via matminer (setup.py) +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) +click==8.1.3 + # via black +contourpy==1.0.6 + # via matplotlib +coverage[toml]==6.5.0 + # via + # coveralls + # matminer (setup.py) + # pytest-cov +coveralls==3.3.1 + # via matminer (setup.py) +cryptography==38.0.3 + # via + # globus-sdk + # pyjwt +cycler==0.11.0 + # via matplotlib +dill==0.3.6 + # via pylint +dnspython==2.2.1 + # via pymongo +docopt==0.6.2 + # via coveralls +dscribe==1.2.2 + # via matminer (setup.py) +emmet-core==0.38.9 + # via mp-api +exceptiongroup==1.0.1 + # via pytest +fair-research-login==0.3.0 + # via mdf-toolbox +flake8==5.0.4 + # via matminer (setup.py) +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==3.14.0 + # via + # fair-research-login + # globus-nexus-client + # mdf-forge + # mdf-toolbox +httplib2==0.21.0 + # via matminer (setup.py) +idna==3.4 + # via requests +importlib-metadata==5.0.0 + # via numba +importlib-resources==5.10.0 + # via jsonschema +iniconfig==1.1.1 + # via pytest +isort==5.10.1 + # via pylint +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 +lazy-object-proxy==1.8.0 + # via astroid +llvmlite==0.39.1 + # via numba +markupsafe==2.1.1 + # via jinja2 +matplotlib==3.6.2 + # via + # ase + # pymatgen +mccabe==0.7.0 + # via + # flake8 + # pylint +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==0.29.4 + # via pymatgen +mpmath==1.2.1 + # via sympy +msgpack==1.0.4 + # via mp-api +mypy-extensions==0.4.3 + # via black +networkx==2.8.8 + # via pymatgen +numba==0.56.4 + # 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 + # pytest +palettable==3.3.0 + # via pymatgen +pandas==1.5.1 + # via + # matminer (setup.py) + # pymatgen +pathspec==0.10.1 + # via black +pillow==9.3.0 + # via matplotlib +platformdirs==2.5.3 + # via + # black + # pylint +plotly==5.11.0 + # via pymatgen +pluggy==1.0.0 + # via pytest +pybind11==2.10.1 + # via dscribe +pybtex==0.24.0 + # via + # emmet-core + # pymatgen +pycodestyle==2.9.1 + # via flake8 +pycparser==2.21 + # via cffi +pydantic==1.10.2 + # via emmet-core +pyflakes==2.5.0 + # via flake8 +pyjwt[crypto]==2.6.0 + # via globus-sdk +pylint==2.15.5 + # via matminer (setup.py) +pymatgen==2022.11.7 + # 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==0.19.2 + # via jsonschema +pytest==7.2.0 + # via + # matminer (setup.py) + # pytest-cov +pytest-cov==4.0.0 + # via matminer (setup.py) +python-dateutil==2.8.2 + # via + # matplotlib + # pandas +pytz==2022.6 + # via pandas +pyyaml==6.0 + # via + # citrination-client + # pybtex +requests==2.28.1 + # via + # citrination-client + # coveralls + # 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==2.0.2 + # 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==2.1.0 + # via aflow +threadpoolctl==3.1.0 + # via scikit-learn +tomli==2.0.1 + # via + # black + # coverage + # pylint + # pytest +tomlkit==0.11.6 + # via pylint +tqdm==4.64.1 + # via + # matminer (setup.py) + # mdf-forge + # pymatgen +typing-extensions==4.4.0 + # via + # astroid + # black + # emmet-core + # globus-sdk + # mp-api + # pydantic + # pylint +ujson==5.5.0 + # via matminer (setup.py) +uncertainties==3.1.7 + # via pymatgen +urllib3==1.26.12 + # via requests +wrapt==1.14.1 + # via astroid +zipp==3.10.0 + # via + # importlib-metadata + # importlib-resources + +# The following packages are considered to be unsafe in a requirements file: +# setuptools diff --git a/requirements/ubuntu-latest_py3.9.txt b/requirements/ubuntu-latest_py3.9.txt new file mode 100644 index 000000000..f14a50f64 --- /dev/null +++ b/requirements/ubuntu-latest_py3.9.txt @@ -0,0 +1,145 @@ +# +# This file is autogenerated by pip-compile with python 3.9 +# To update, run: +# +# pip-compile --output-file=requirements/ubuntu-latest_py3.9.txt +# +certifi==2022.9.24 + # via requests +charset-normalizer==2.1.1 + # via requests +contourpy==1.0.6 + # via matplotlib +cycler==0.11.0 + # via matplotlib +dnspython==2.2.1 + # via pymongo +emmet-core==0.38.9 + # 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 +kiwisolver==1.4.4 + # via matplotlib +latexcodec==2.0.1 + # via pybtex +matplotlib==3.6.2 + # via pymatgen +monty==2022.9.9 + # via + # emmet-core + # matminer (setup.py) + # mp-api + # pymatgen +mp-api==0.29.4 + # via pymatgen +mpmath==1.2.1 + # via sympy +msgpack==1.0.4 + # via mp-api +networkx==2.8.8 + # 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==9.3.0 + # via matplotlib +plotly==5.11.0 + # via pymatgen +pybtex==0.24.0 + # via + # emmet-core + # pymatgen +pydantic==1.10.2 + # via emmet-core +pymatgen==2022.11.7 + # via + # emmet-core + # matminer (setup.py) + # mp-api +pymongo==4.3.2 + # via matminer (setup.py) +pyparsing==3.0.9 + # via + # matplotlib + # packaging +python-dateutil==2.8.2 + # via + # matplotlib + # pandas +pytz==2022.6 + # 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==2.0.2 + # 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 diff --git a/requirements/ubuntu-latest_py3.9_extras.txt b/requirements/ubuntu-latest_py3.9_extras.txt new file mode 100644 index 000000000..2c75deec3 --- /dev/null +++ b/requirements/ubuntu-latest_py3.9_extras.txt @@ -0,0 +1,312 @@ +# +# This file is autogenerated by pip-compile with python 3.9 +# To update, run: +# +# pip-compile --all-extras --output-file=requirements/ubuntu-latest_py3.9_extras.txt +# +aflow==0.0.11 + # via matminer (setup.py) +ase==3.22.1 + # via + # aflow + # dscribe + # matminer (setup.py) +astroid==2.12.12 + # via pylint +attrs==22.1.0 + # via + # jsonschema + # pytest +beautifulsoup4==4.11.1 + # via aflow +black==22.10.0 + # via matminer (setup.py) +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) +click==8.1.3 + # via black +contourpy==1.0.6 + # via matplotlib +coverage[toml]==6.5.0 + # via + # coveralls + # matminer (setup.py) + # pytest-cov +coveralls==3.3.1 + # via matminer (setup.py) +cryptography==38.0.3 + # via + # globus-sdk + # pyjwt +cycler==0.11.0 + # via matplotlib +dill==0.3.6 + # via pylint +dnspython==2.2.1 + # via pymongo +docopt==0.6.2 + # via coveralls +dscribe==1.2.2 + # via matminer (setup.py) +emmet-core==0.38.9 + # via mp-api +exceptiongroup==1.0.1 + # via pytest +fair-research-login==0.3.0 + # via mdf-toolbox +flake8==5.0.4 + # via matminer (setup.py) +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==3.14.0 + # via + # fair-research-login + # globus-nexus-client + # mdf-forge + # mdf-toolbox +httplib2==0.21.0 + # via matminer (setup.py) +idna==3.4 + # via requests +iniconfig==1.1.1 + # via pytest +isort==5.10.1 + # via pylint +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 +lazy-object-proxy==1.8.0 + # via astroid +llvmlite==0.39.1 + # via numba +markupsafe==2.1.1 + # via jinja2 +matplotlib==3.6.2 + # via + # ase + # pymatgen +mccabe==0.7.0 + # via + # flake8 + # pylint +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==0.29.4 + # via pymatgen +mpmath==1.2.1 + # via sympy +msgpack==1.0.4 + # via mp-api +mypy-extensions==0.4.3 + # via black +networkx==2.8.8 + # via pymatgen +numba==0.56.4 + # 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 + # pytest +palettable==3.3.0 + # via pymatgen +pandas==1.5.1 + # via + # matminer (setup.py) + # pymatgen +pathspec==0.10.1 + # via black +pillow==9.3.0 + # via matplotlib +platformdirs==2.5.3 + # via + # black + # pylint +plotly==5.11.0 + # via pymatgen +pluggy==1.0.0 + # via pytest +pybind11==2.10.1 + # via dscribe +pybtex==0.24.0 + # via + # emmet-core + # pymatgen +pycodestyle==2.9.1 + # via flake8 +pycparser==2.21 + # via cffi +pydantic==1.10.2 + # via emmet-core +pyflakes==2.5.0 + # via flake8 +pyjwt[crypto]==2.6.0 + # via globus-sdk +pylint==2.15.5 + # via matminer (setup.py) +pymatgen==2022.11.7 + # 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==0.19.2 + # via jsonschema +pytest==7.2.0 + # via + # matminer (setup.py) + # pytest-cov +pytest-cov==4.0.0 + # via matminer (setup.py) +python-dateutil==2.8.2 + # via + # matplotlib + # pandas +pytz==2022.6 + # via pandas +pyyaml==6.0 + # via + # citrination-client + # pybtex +requests==2.28.1 + # via + # citrination-client + # coveralls + # 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==2.0.2 + # 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==2.1.0 + # via aflow +threadpoolctl==3.1.0 + # via scikit-learn +tomli==2.0.1 + # via + # black + # coverage + # pylint + # pytest +tomlkit==0.11.6 + # via pylint +tqdm==4.64.1 + # via + # matminer (setup.py) + # mdf-forge + # pymatgen +typing-extensions==4.4.0 + # via + # astroid + # black + # emmet-core + # globus-sdk + # mp-api + # pydantic + # pylint +ujson==5.5.0 + # via matminer (setup.py) +uncertainties==3.1.7 + # via pymatgen +urllib3==1.26.12 + # via requests +wrapt==1.14.1 + # via astroid + +# The following packages are considered to be unsafe in a requirements file: +# setuptools