pyproject.toml

[build-system]
# build the package with [flit](https://flit.readthedocs.io)
requires = ["flit_core >=3.4,<4"]
build-backend = "flit_core.buildapi"

[project]
# See https://www.python.org/dev/peps/pep-0621/
name = "aiida-calcmonitor"
dynamic = ["version"]  # read from aiida_calcmonitor/__init__.py
description = "Description pending."
authors = [{name = "FFR"}]
readme = "README.md"
license = {file = "LICENSE"}
classifiers = [
    "Programming Language :: Python",
    "Intended Audience :: Science/Research",
    "License :: OSI Approved :: MIT License",
    "Natural Language :: English",
    "Development Status :: 3 - Alpha",
    "Framework :: AiiDA"
]
keywords = ["aiida", "plugin"]
requires-python = ">=3.8"
dependencies = [
    "aiida-core>=1.6,<3",
    "numpy"
]

[project.urls]
Source = "https://github.com/ramirezfranciscof/aiida-calcmonitor"

[project.optional-dependencies]
testing = [
    "pgtest~=1.3.1",
    "wheel~=0.31",
    "coverage[toml]",
    "pytest~=6.0",
    "pytest-cov"
]
pre-commit = [
    "pre-commit~=2.2",
    "pylint>=2.5.0,<2.9"
]
docs = [
    "sphinx",
    "sphinxcontrib-contentui",
    "sphinxcontrib-details-directive",
    "furo",
    "markupsafe<2.1"
]

[project.entry-points."aiida.workflows"]
"calcmonitor.monitor_wrapper" = "aiida_calcmonitor.workflows.monitor_wrapper:MonitorWrapperWorkChain"
"calcmonitor.monitored_cycler" = "aiida_calcmonitor.workflows.monitored_cycler:MonitoredCyclerWorkChain"

[project.entry-points."aiida.calculations"]
"calcmonitor.calcjob_monitor" = "aiida_calcmonitor.calculations.calcjob_monitor:CalcjobMonitor"
"calcmonitor.toymodel_calcjob" = "aiida_calcmonitor.calculations.toymodel_calcjob:ToymodelCalcjob"

[project.entry-points.'aiida.parsers']
'calcmonitor.cycler' = 'aiida_calcmonitor.parsers.monitor_tomato:TomatoMonitorParser'

[project.entry-points."aiida.data"]
"calcmonitor.monitor.toymodel" = "aiida_calcmonitor.data.monitors.monitor_toymodel:MonitorToymodel"
"calcmonitor.monitor.tomatodummy" = "aiida_calcmonitor.data.monitors.monitor_tomato:MonitorTomatoDummy"
"calcmonitor.monitor.tomatobiologic" = "aiida_calcmonitor.data.monitors.monitor_tomato:MonitorTomatoBioLogic"

[project.entry-points."aiida.cmdline.data"]
"aiida-calcmonitor" = "aiida_calcmonitor.cli:root"

[tool.flit.module]
name = "aiida_calcmonitor"

[tool.pylint.format]
max-line-length = 125

[tool.pylint.messages_control]
disable = [
    "too-many-ancestors",
    "invalid-name",
    "duplicate-code",
    # black compatibility
    "C0330",
    "C0326",
]

[tool.pytest.ini_options]
# Configuration for [pytest](https://docs.pytest.org)
python_files = "test_*.py example_*.py"
filterwarnings = [
    "ignore::DeprecationWarning:aiida:",
    "ignore::DeprecationWarning:plumpy:",
    "ignore::DeprecationWarning:yaml:",
]

[tool.coverage.run]
# Configuration of [coverage.py](https://coverage.readthedocs.io)
# reporting which lines of your plugin are covered by tests
source=["aiida_calcmonitor"]

[tool.isort]
# Configuration of [isort](https://isort.readthedocs.io)
line_length = 120
force_sort_within_sections = true
sections = ['FUTURE', 'STDLIB', 'THIRDPARTY', 'AIIDA', 'FIRSTPARTY', 'LOCALFOLDER']
known_aiida = ['aiida']

[tool.tox]
legacy_tox_ini = """
[tox]
envlist = py38

[testenv]
usedevelop=True

[testenv:py{38,39,310}]
description = Run the test suite against a python version
extras = testing
setenv =
    AIIDA_WARN_v3 = 1
commands = pytest {posargs}

[testenv:pre-commit]
description = Run the pre-commit checks
extras =
    pre-commit
    testing
commands = pre-commit run {posargs}

[testenv:docs]
description = Build the documentation
extras = docs
commands = sphinx-build -nW --keep-going -b html {posargs} docs/source docs/build/html
commands_post = echo "open file://{toxinidir}/docs/build/html/index.html"
"""