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tasks.py
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"""Pyinvoke tasks.py file for automating releases and admin stuff."""
from __future__ import annotations
import glob
import json
import os
import re
import shutil
from pprint import pprint
import matcalc
import requests
from invoke import task
from monty.os import cd
NEW_VER = matcalc.__version__
@task
def make_tutorials(ctx):
ctx.run("rm -rf docs/tutorials")
ctx.run("jupyter nbconvert examples/*.ipynb --to=markdown --output-dir=docs/tutorials")
for fn in glob.glob("docs/tutorials/*/*.png"):
ctx.run(f'mv "{fn}" docs/assets')
for fn in os.listdir("docs/tutorials"):
lines = [
"---",
"layout: default",
"title: " + fn,
"nav_exclude: true",
"---",
"",
]
path = f"docs/tutorials/{fn}"
if os.path.isdir(path):
shutil.rmtree(path)
elif fn.endswith(".md"):
with open(path) as file:
for line in file:
line = line.rstrip() # noqa: PLW2901
if line.startswith("![png]"):
t1, t2 = line.split("(")
t2, t3 = t2.split("/")
lines.append(t1 + "(assets/" + t3)
else:
lines.append(line)
with open(path, "w") as file:
file.write("\n".join(lines))
@task
def make_docs(ctx):
"""
This new version requires markdown builder.
pip install sphinx-markdown-builder
Adding the following to conf.py
extensions = [
'sphinx_markdown_builder'
]
Build markdown files with sphinx-build command
sphinx-build -M markdown ./ build
"""
make_tutorials(ctx)
with cd("docs"):
ctx.run("cp ../README.md index.md", warn=True)
ctx.run("rm matcalc.*.rst", warn=True)
ctx.run("sphinx-apidoc -P -M -d 6 -o . -f ../src/matcalc")
ctx.run("cp modules.rst index.rst")
ctx.run("sphinx-build -M markdown . .")
ctx.run("rm *.rst", warn=True)
ctx.run("cp markdown/matcalc*.md .")
for fn in glob.glob("matcalc*.md"):
with open(fn) as f:
lines = [line.rstrip() for line in f if "Submodules" not in line]
if fn == "matcalc.md":
preamble = [
"---",
"layout: default",
"title: API Documentation",
"nav_order: 5",
"---",
"",
]
else:
preamble = [
"---",
"layout: default",
"title: " + fn,
"nav_exclude: true",
"---",
"",
]
with open(fn, "w") as f:
f.write("\n".join(preamble + lines))
ctx.run("rm -r markdown", warn=True)
ctx.run("cp ../*.md .")
ctx.run("mv README.md index.md")
ctx.run("rm -rf *.orig doctrees", warn=True)
with open("index.md") as f:
contents = f.read()
with open("index.md", "w") as f:
contents = re.sub(
r"\n## Official Documentation[^#]*",
"{: .no_toc }\n\n## Table of contents\n{: .no_toc .text-delta }\n* TOC\n{:toc}\n\n",
contents,
)
contents = "---\nlayout: default\ntitle: Home\nnav_order: 1\n---\n\n" + contents
f.write(contents)
@task
def publish(ctx):
ctx.run("rm dist/*.*", warn=True)
ctx.run("python -m build")
ctx.run("python -m build --wheel")
ctx.run("twine upload dist/*")
@task
def release_github(ctx): # noqa: ARG001
desc = get_changelog()
payload = {
"tag_name": "v" + NEW_VER,
"target_commitish": "main",
"name": "v" + NEW_VER,
"body": desc,
"draft": False,
"prerelease": False,
}
response = requests.post(
"https://api.github.com/repos/materialsvirtuallab/matcalc/releases",
data=json.dumps(payload),
headers={"Authorization": "token " + os.environ["GITHUB_RELEASES_TOKEN"]},
timeout=10,
)
pprint(response.json())
@task
def release(ctx, notest: bool = False) -> None: # noqa: FBT001, FBT002
ctx.run("rm -r dist build matcalc.egg-info", warn=True)
if not notest:
ctx.run("pytest tests")
release_github(ctx)
def get_changelog():
with open("changes.md") as f:
contents = f.read()
match = re.search(f"## v{NEW_VER}([^#]*)", contents)
if not match:
raise ValueError("could not parse latest version from changes.md")
return match.group(1).strip()
@task
def view_docs(ctx) -> None:
with cd("docs"):
ctx.run("bundle exec jekyll serve")