pyproject.toml

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


[project]
name = "qeflow"
description = "Python tool to perform quantum espresso workflows without scassamento di maroni"
readme = "README.md"
requires-python = ">=3.8"
license = {file = "LICENSE"}
keywords = ["qe", "quantum", "espresso", "workflow", "workflow-automation", "hpc"]
authors = [
    {name = "Stefano Dal Forno", email = "tenobaldi@gmail.com"},]
maintainers = [
    {name = "Stefano Dal Forno", email = "tenobaldi@gmail.com"}]
classifiers = [
    "Development Status :: 4 - Beta",
    "Programming Language :: Python"]

dependencies = ['xmltodict', 'pyyaml']

# dynamic version
dynamic = ["version"]
[tool.setuptools.dynamic]
version = {attr = "qeflow.__version__"}


[tool.setuptools]
packages = ["qeflow"]


[project.urls]
#Homepage = "https://example.com"
#Documentation = "https://readthedocs.org"
Examples = "https://github.com/t3n0/qeflow/examples"
Repository = "https://github.com/t3n0/qeflow"
Changelog = "https://github.com/t3n0/qeflow/blob/main/CHANGELOG.md"


[project.scripts]
qeflow = "qeflow.main:qeflow"
qetask = "qeflow.main:qetask"
qeparse = "qeflow.main:qeparse"