pyproject.toml

[tool.poetry]
name = "pura"
version = "0.2.4"
description = "Clean chemical data quickly"
authors = ["Kobi Felton <kobi.c.f@gmail.com>"]
license = "MIT"

[tool.poetry.dependencies]
python = ">=3.8,<3.9.7 || >3.9.7,<3.11"
Pint = "^0.20"
pydantic = "^1.9.1"
tqdm = "^4.64.0"
aiohttp = "^3.8.1"
rdkit-pypi = "^2022.3.3"
lxml = "^4.9.0"
python-dotenv = "^0.20.0"
unicodedata2 = { version = "^14.0.0", optional = true }
pystow = { version = "^0.4.5", optional = true }
tensorflow-gpu = { version = "2.7.2", optional = true }
pandas = "^1.4.3"
nest-asyncio = "^1.5.6"
streamlit = "^1.16.0"
stqdm = "^0.0.4"
databases = { version = "^0.7.0", extras = ["aiosqlite"] }
importlib-resources = "^5.12.0"

[tool.poetry.extras]
stout = ["unicodedata2", "pystow", "tensorflow-gpu"]

[tool.poetry.dev-dependencies]
black = "^22.6.0"
pytest = "^7.2.0"

[build-system]
requires = ["poetry-core>=1.0.0"]
build-backend = "poetry.core.masonry.api"