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deployment.txt
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#
# This file is autogenerated by pip-compile with Python 3.10
# by the following command:
#
# pip-compile --output-file=emmet/emmet-builders/requirements/deployment.txt emmet/emmet-builders/setup.py python/requirements.txt
#
aiohttp==3.10.2
# via fsspec
aioitertools==0.11.0
# via maggma
aiosignal==1.3.1
# via aiohttp
annotated-types==0.6.0
# via pydantic
anyio==4.2.0
# via starlette
ase==3.22.1
# via
# chgnet
# matcalc
# matgl
async-timeout==4.0.3
# via aiohttp
attrs==23.2.0
# via
# aiohttp
# jsonschema
# referencing
bcrypt==4.1.2
# via paramiko
blinker==1.7.0
# via flask
boto3==1.34.34
# via maggma
botocore==1.34.34
# via
# boto3
# s3transfer
certifi==2024.7.4
# via requests
cffi==1.16.0
# via
# cryptography
# pynacl
charset-normalizer==3.3.2
# via requests
chgnet==0.3.3
# via emmet-core
click==8.1.7
# via
# flask
# mongogrant
# uvicorn
contourpy==1.2.0
# via matplotlib
cryptography==43.0.1
# via paramiko
cycler==0.12.1
# via matplotlib
cython==3.0.8
# via chgnet
dgl==1.1.3
# via matgl
dnspython==2.6.1
# via
# maggma
# pymongo
emmet-core[all,ml]==0.77.0
# via emmet-builders (emmet/emmet-builders/setup.py)
exceptiongroup==1.2.0
# via anyio
fastapi==0.109.2
# via maggma
filelock==3.13.1
# via
# torch
# triton
flask==3.0.2
# via mongogrant
fonttools==4.47.2
# via matplotlib
frozenlist==1.4.1
# via
# aiohttp
# aiosignal
fsspec[http]==2024.2.0
# via
# pytorch-lightning
# torch
future==0.18.3
# via
# matminer
# uncertainties
h11==0.14.0
# via uvicorn
h5py==3.10.0
# via phonopy
idna==3.7
# via
# anyio
# requests
# yarl
inflect==7.0.0
# via robocrys
itsdangerous==2.1.2
# via flask
jinja2==3.1.4
# via
# flask
# torch
jmespath==1.0.1
# via
# boto3
# botocore
joblib==1.3.2
# via
# matcalc
# pymatgen
# pymatgen-analysis-diffusion
# scikit-learn
jsonschema==4.21.1
# via maggma
jsonschema-specifications==2023.12.1
# via jsonschema
kiwisolver==1.4.5
# via matplotlib
latexcodec==2.0.1
# via pybtex
lightning-utilities==0.10.1
# via
# pytorch-lightning
# torchmetrics
maggma==0.62.0
# via emmet-builders (emmet/emmet-builders/setup.py)
markupsafe==2.1.5
# via
# jinja2
# werkzeug
matcalc==0.0.4
# via emmet-core
matgl==0.9.2
# via emmet-core
matminer==0.9.0
# via
# emmet-builders (emmet/emmet-builders/setup.py)
# robocrys
matplotlib==3.8.2
# via
# -r python/requirements.txt
# ase
# phonopy
# pymatgen
mongogrant==0.3.3
# via maggma
mongomock==4.1.2
# via maggma
monty==2024.2.2
# via
# emmet-core
# maggma
# matminer
# pymatgen
# robocrys
mpmath==1.3.0
# via sympy
msgpack==1.0.7
# via maggma
multidict==6.0.5
# via
# aiohttp
# yarl
networkx==3.2.1
# via
# dgl
# pymatgen
# robocrys
# torch
numpy==1.26.3
# via
# -r python/requirements.txt
# ase
# chgnet
# contourpy
# dgl
# h5py
# maggma
# matminer
# matplotlib
# pandas
# phonopy
# pymatgen
# pytorch-lightning
# robocrys
# scikit-learn
# scipy
# seekpath
# shapely
# spglib
# torchmetrics
nvidia-cublas-cu12==12.1.3.1
# via
# nvidia-cudnn-cu12
# nvidia-cusolver-cu12
# torch
nvidia-cuda-cupti-cu12==12.1.105
# via torch
nvidia-cuda-nvrtc-cu12==12.1.105
# via torch
nvidia-cuda-runtime-cu12==12.1.105
# via torch
nvidia-cudnn-cu12==8.9.2.26
# via torch
nvidia-cufft-cu12==11.0.2.54
# via torch
nvidia-curand-cu12==10.3.2.106
# via torch
nvidia-cusolver-cu12==11.4.5.107
# via torch
nvidia-cusparse-cu12==12.1.0.106
# via
# nvidia-cusolver-cu12
# torch
nvidia-ml-py3==7.352.0
# via chgnet
nvidia-nccl-cu12==2.19.3
# via torch
nvidia-nvjitlink-cu12==12.3.101
# via
# nvidia-cusolver-cu12
# nvidia-cusparse-cu12
nvidia-nvtx-cu12==12.1.105
# via torch
orjson==3.9.15
# via maggma
packaging==23.2
# via
# lightning-utilities
# matplotlib
# mongomock
# plotly
# pytorch-lightning
# torchmetrics
palettable==3.3.3
# via pymatgen
pandas==1.5.3
# via
# -r python/requirements.txt
# matminer
# pymatgen
paramiko==3.4.0
# via sshtunnel
phonopy==2.21.0
# via matcalc
pillow==10.3.0
# via matplotlib
plotly==5.18.0
# via pymatgen
psutil==5.9.8
# via dgl
pubchempy==1.0.4
# via robocrys
pybtex==0.24.0
# via
# emmet-core
# pymatgen
# robocrys
pycparser==2.21
# via cffi
pydantic==2.6.1
# via
# emmet-core
# fastapi
# inflect
# maggma
# pydantic-settings
pydantic-core==2.16.2
# via pydantic
pydantic-settings==2.1.0
# via
# emmet-core
# maggma
pydash==7.0.7
# via maggma
pymatgen==2024.2.20
# via
# chgnet
# emmet-core
# matcalc
# matgl
# matminer
# pymatgen-analysis-alloys
# pymatgen-analysis-diffusion
# robocrys
pymatgen-analysis-alloys==0.0.6
# via emmet-core
pymatgen-analysis-diffusion==2023.8.15
# via emmet-core
pymongo==4.6.3
# via
# maggma
# matminer
# mongogrant
pynacl==1.5.0
# via paramiko
pyparsing==3.1.1
# via matplotlib
python-dateutil==2.8.2
# via
# botocore
# maggma
# matplotlib
# pandas
python-dotenv==1.0.1
# via pydantic-settings
pytorch-lightning==2.1.4
# via matgl
pytz==2024.1
# via pandas
pyyaml==6.0.1
# via
# phonopy
# pybtex
# pytorch-lightning
pyzmq==25.1.2
# via maggma
referencing==0.33.0
# via
# jsonschema
# jsonschema-specifications
requests==2.32.2
# via
# dgl
# matminer
# mongogrant
# pymatgen
robocrys==0.2.8
# via emmet-core
rpds-py==0.17.1
# via
# jsonschema
# referencing
ruamel-yaml==0.17.40
# via
# maggma
# pymatgen
# robocrys
ruamel-yaml-clib==0.2.8
# via ruamel-yaml
s3transfer==0.10.0
# via boto3
scikit-learn==1.5.0
# via matminer
scipy==1.12.0
# via
# -r python/requirements.txt
# ase
# dgl
# pymatgen
# robocrys
# scikit-learn
seekpath==2.1.0
# via emmet-core
sentinels==1.0.0
# via mongomock
shapely==2.0.2
# via pymatgen-analysis-alloys
six==1.16.0
# via
# latexcodec
# pybtex
# python-dateutil
sniffio==1.3.0
# via anyio
spglib==2.3.0
# via
# phonopy
# pymatgen
# robocrys
# seekpath
sshtunnel==0.4.0
# via maggma
starlette==0.40.0
# via fastapi
sympy==1.12
# via
# matminer
# pymatgen
# torch
tabulate==0.9.0
# via pymatgen
tenacity==8.2.3
# via plotly
threadpoolctl==3.2.0
# via scikit-learn
torch==2.2.0
# via
# chgnet
# matgl
# pytorch-lightning
# torchmetrics
torchmetrics==1.3.0.post0
# via pytorch-lightning
tqdm==4.66.3
# via
# dgl
# maggma
# matminer
# pymatgen
# pytorch-lightning
triton==2.2.0
# via torch
typing-extensions==4.9.0
# via
# anyio
# emmet-core
# fastapi
# inflect
# lightning-utilities
# pydantic
# pydantic-core
# pydash
# pytorch-lightning
# torch
# uvicorn
uncertainties==3.1.7
# via pymatgen
urllib3==2.2.2
# via
# botocore
# requests
uvicorn==0.27.0.post1
# via maggma
werkzeug==3.0.3
# via flask
yarl==1.9.4
# via aiohttp
# The following packages are considered to be unsafe in a requirements file:
# setuptools