molecule-resolver/pyproject.toml at main · MoleculeResolver/molecule-resolver · GitHub

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[tool.poetry]
name = "molecule-resolver"
version = "0.5.2"
description = "A package to use several web services to find molecule structures, synonyms and CAS."
authors = [
    "Simon Muller <simon.mueller@tuhh.de>",
    "Kobi Felton <kobi.c.f@gmail.com>",
]
license = "MIT"
readme = "README.md"
packages = [{ include = "moleculeresolver" }]

[tool.poetry.dependencies]
python = "^3.10,<3.14"
prompt-toolkit = "^3.0.39"
regex = ">=2023.10.3"
rdkit = ">=2023.3.3"
requests = "^2.31.0"
openpyxl = "^3.1.2"
tqdm = "^4.66.3"
urllib3 = "^2.0.6"
xmltodict = ">=0.13.0"


[tool.poetry.group.dev.dependencies]
pytest = "^7.4.3"
pytest-mock = "^3.12.0"
sphinx = "^8.1.3"
sphinx-autobuild = "^2024.10.3"
sphinx-autoapi = "^3.4.0"

[build-system]
requires = ["poetry-core"]
build-backend = "poetry.core.masonry.api"