pyproject.toml

[build-system]
requires = ["setuptools >= 61.0"]
build-backend = "setuptools.build_meta"

[project]
name = "careless"
authors=[
    {name="Kevin M. Dalton", email="kmdalton@slac.stanford.edu"}
]
description = "Merging crystallography data without much physics."
readme = "README.md"
dynamic = ["version"]
requires-python = ">= 3.9,<3.13"
dependencies = [
    "reciprocalspaceship>=0.9.16",
    "tqdm",
    "tensorflow-probability[tf]==0.25",
    "tensorflow==2.18.0",
    "matplotlib",
    "seaborn",
    "ray",
]

license={text = "MIT"}

[project.optional-dependencies]
dev = [
    "pytest", 
    "pytest-cov",
    "pytest-xdist",
]
cuda = [
    "tensorflow[and-cuda]==2.18.0",
]

[project.urls]
Repository = "https://github.com/rs-station/careless"
Examples = "https://github.com/rs-station/careless-examples"
Issues = "https://github.com/rs-station/careless/issues"

[project.scripts]
careless = "careless.careless:main"
"careless.ccanom" = "careless.stats.ccanom:main"
"careless.cchalf" = "careless.stats.cchalf:main"
"careless.ccpred" = "careless.stats.ccpred:main"
"careless.image_ccpred" = "careless.stats.image_cc:main"
"careless.isigi" = "careless.stats.isigi:main"
"careless.filter_image" = "careless.stats.filter_by_image_cc:main"
"careless.plot_history" = "careless.stats.history:main"
"careless.bfactor" = "careless.stats.prior_b:main"
"careless.apply_bfactor" = "careless.stats.rescale:main"
"careless.completeness" = "careless.stats.completeness:main"
"careless.rsplit" = "careless.stats.rsplit:main"
"careless.xds2mtz" = "careless.io.xds:main"

[tool.pytest.ini_options]
addopts = "-n auto --cov=careless --cov-config=.coveragerc --cov-report xml"
testpaths = [
    "tests",
]

[tool.setuptools.dynamic]
version = {file = "careless/VERSION"}