pyproject.toml

[project]
name = "promdens"
version = "1.0.1"
authors = [
  { name="Jiri Janos", email="jiri.janos98@gmail.com" },
  { name="Daniel Hollas", email="danekhollas@gmail.com" },
]
license = {file = 'LICENSE'}
classifiers = [
  'Development Status :: 5 - Production/Stable',
  'License :: OSI Approved :: MIT License',
  'Programming Language :: Python',
  'Programming Language :: Python :: 3 :: Only',
  'Topic :: Scientific/Engineering'
]
description = "Promoted Density Approach for sampling initial conditions for trajectory-based nonadiabatic photodynamics"
readme = "README.md"
requires-python = ">=3.7"
dependencies = [
    "numpy>=1.15",
    "matplotlib~=3.0",
]

[project.urls]
Homepage = "https://github.com/PHOTOX/promdens"
Documentation = "https://github.com/PHOTOX/promdens/blob/main/README.md"
Repository = "https://github.com/PHOTOX/promdens.git"
Issues = "https://github.com/PHOTOX/promdens/issues"

[project.scripts]
promdens = "promdens:main"

[project.optional-dependencies]
tests = [
    "inline-snapshot>=0.9,!=0.13.2",
    "pytest>=7.4",
]

[build-system]
requires = ["hatchling"]
build-backend = "hatchling.build"

[tool.hatch.build.targets.sdist]
exclude = ["supplementary"]

[tool.pytest.ini_options]
filterwarnings = [
    # See https://github.com/PHOTOX/promdens/issues/9
    "ignore:`trapz` is deprecated.*:DeprecationWarning:",
]