diff --git a/.github/workflows/tests.yml b/.github/workflows/tests.yml index 0402c423..910b014b 100644 --- a/.github/workflows/tests.yml +++ b/.github/workflows/tests.yml @@ -13,43 +13,49 @@ jobs: strategy: matrix: python-version: ['3.12'] - + steps: - name: Checkout uses: actions/checkout@v4 - + - name: Set up Python ${{ matrix.python-version }} uses: actions/setup-python@v5 with: python-version: ${{ matrix.python-version }} - + - name: Install system dependencies run: | sudo apt-get update sudo apt-get install -y build-essential libffi-dev libssl-dev zlib1g-dev libbz2-dev libreadline-dev libsqlite3-dev libncurses5-dev libncursesw5-dev xz-utils tk-dev libxml2-dev libxmlsec1-dev libffi-dev liblzma-dev libjpeg-dev libpng-dev libtiff-dev libwebp-dev libopenjp2-7-dev libharfbuzz-dev libfribidi-dev libfreetype6-dev libfontconfig1-dev libblas-dev liblapack-dev libatlas-base-dev gfortran libpoppler-cpp-dev libpoppler-dev libhdf5-dev libnetcdf-dev libgl1 libglib2.0-0 libsm6 libxext6 libxrender-dev libgomp1 libcairo2-dev libpango1.0-dev libpangocairo-1.0-0 libgdk-pixbuf2.0-dev libffi-dev shared-mime-info graphviz libgraphviz-dev - + - name: Cache dependencies uses: actions/cache@v3 with: path: ~/.cache/pip key: ${{ runner.os }}-pip-${{ hashFiles('**/pyproject.toml') }} - + - name: Cache SDK generation uses: actions/cache@v3 with: path: src/tooluniverse/tools key: ${{ runner.os }}-sdk-${{ hashFiles('scripts/build_tools.py', 'src/tooluniverse/data/*.json') }} - + - name: Install uv uses: astral-sh/setup-uv@v3 - + - name: Install project with dev extras run: | uv pip install -e .[dev] --system - + + - name: Check code formatting/linting requirements + uses: astral-sh/ruff-action@v3 + with: + version: "latest" + run: ruff check + - name: Generate SDK run: python scripts/build_tools.py - + - name: Run fast tests (excluding tools, examples, and api) run: | pytest tests/ -v \ @@ -61,30 +67,28 @@ jobs: --ignore=tests/tools \ --ignore=tests/examples \ --ignore=tests/api - + - name: Test doctor CLI tool run: | python -m src.tooluniverse.doctor - + - name: Run tools, examples, and api tests (optional, requires network) if: github.event.inputs.run_tools_tests == 'true' || github.event_name == 'workflow_dispatch' run: | pytest tests/tools/ tests/examples/ tests/api/ -v \ --tb=short \ -m "not slow and not require_api_keys" - + - name: Upload coverage to Codecov uses: codecov/codecov-action@v3 if: github.ref == 'refs/heads/main' with: file: ./coverage.xml fail_ci_if_error: false - + - name: Upload test results if: always() uses: actions/upload-artifact@v4 with: name: test-results-${{ matrix.python-version }} - path: coverage.xml - - + path: coverage.xml \ No newline at end of file diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml index 638b9251..c66ec777 100644 --- a/.pre-commit-config.yaml +++ b/.pre-commit-config.yaml @@ -8,38 +8,19 @@ exclude: | ) repos: - - repo: https://github.com/pre-commit/pre-commit-hooks rev: v6.0.0 hooks: - id: end-of-file-fixer - id: trailing-whitespace - - id: check-ast - id: check-yaml - id: check-toml - - repo: https://github.com/psf/black - rev: 25.9.0 - hooks: - - id: black - args: ["--line-length=88"] - language_version: python3 - - - repo: https://github.com/PyCQA/autoflake - rev: v2.3.1 - hooks: - - id: autoflake - args: ["--remove-all-unused-imports", "--remove-unused-variables", "--in-place"] - - - repo: https://github.com/PyCQA/flake8 - rev: 7.3.0 - hooks: - - id: flake8 - additional_dependencies: ["flake8-bugbear"] - args: ["--max-line-length=88", "--extend-ignore=E501,F401,F541,E203,W503"] - - repo: https://github.com/astral-sh/ruff-pre-commit - rev: v0.14.4 + rev: v0.14.5 hooks: - - id: ruff - args: ["--fix", "--line-length=88", "--ignore=E203"] \ No newline at end of file + # Run the linter. + - id: ruff-check + args: [ --fix ] # automatically fix linting issues + # Run the formatter. + - id: ruff-format \ No newline at end of file diff --git a/pyproject.toml b/pyproject.toml index e4cc5799..d58cf090 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -12,7 +12,7 @@ authors = [ dependencies = [ "requests>=2.32.0", "numpy>=2.2.0", - "sympy>=1.12.0", # Symbolic mathematics for Python executor + "sympy>=1.12.0", # Symbolic mathematics for Python executor "graphql-core>=3.2.0", "fastapi>=0.116.0", "uvicorn>=0.35.0", @@ -31,7 +31,7 @@ dependencies = [ "rcsb-api>=1.4.0", "fitz>=0.0.1.dev2", "pandas>=2.2.3", - "setuptools>=70.0.0,<81.0.0", # Fix pkg_resources deprecation warnings + "setuptools>=70.0.0,<81.0.0", # Fix pkg_resources deprecation warnings "pdfplumber>=0.11.0", "playwright>=1.55.0", "faiss-cpu>=1.12.0", @@ -58,12 +58,11 @@ dev = [ "pytest-timeout>=2.3.1", "pytest-mock>=3.14.0", "pytest-asyncio>=0.21.0", - "requests-mock>=1.12.1", - "black>=22.0", - "flake8>=4.0", "pre-commit>=2.0", "pytest-xdist>=3.0", "pytest-html>=3.0", + "requests-mock>=1.12.1", + "ruff>=0.14.5", ] docs = [ "sphinx>=4.0", @@ -155,4 +154,16 @@ dev = [ ] [tool.uv.sources] -tooluniverse = { workspace = true } \ No newline at end of file +tooluniverse = { workspace = true } + +[tool.ruff] +line-length = 88 +exclude = [ + ".venv", + "docs", + "examples", +] +unsafe-fixes = true + +[tool.ruff.lint] +ignore = ["E203", "E402", "E501", "F401", "F541"] \ No newline at end of file diff --git a/uv.lock b/uv.lock index 39a98a14..62c5ee02 100644 --- a/uv.lock +++ b/uv.lock @@ -1,5 +1,5 @@ version = 1 -revision = 2 +revision = 3 requires-python = ">=3.10" resolution-markers = [ "python_full_version < '3.11'", @@ -363,40 +363,6 @@ wheels = [ { url = "https://files.pythonhosted.org/packages/94/fe/3aed5d0be4d404d12d36ab97e2f1791424d9ca39c2f754a6285d59a3b01d/beautifulsoup4-4.14.2-py3-none-any.whl", hash = "sha256:5ef6fa3a8cbece8488d66985560f97ed091e22bbc4e9c2338508a9d5de6d4515", size = 106392, upload-time = "2025-09-29T10:05:43.771Z" }, ] -[[package]] -name = "black" -version = "25.1.0" -source = { registry = "https://pypi.org/simple" } -dependencies = [ - { name = "click" }, - { name = "mypy-extensions" }, - { name = "packaging" }, - { name = "pathspec" }, - { name = "platformdirs" }, - { name = "tomli", marker = "python_full_version < '3.11'" }, - { name = "typing-extensions", marker = "python_full_version < '3.11'" }, -] -sdist = { url = "https://files.pythonhosted.org/packages/94/49/26a7b0f3f35da4b5a65f081943b7bcd22d7002f5f0fb8098ec1ff21cb6ef/black-25.1.0.tar.gz", hash = "sha256:33496d5cd1222ad73391352b4ae8da15253c5de89b93a80b3e2c8d9a19ec2666", size = 649449, upload-time = "2025-01-29T04:15:40.373Z" } -wheels = [ - { url = "https://files.pythonhosted.org/packages/4d/3b/4ba3f93ac8d90410423fdd31d7541ada9bcee1df32fb90d26de41ed40e1d/black-25.1.0-cp310-cp310-macosx_10_9_x86_64.whl", hash = "sha256:759e7ec1e050a15f89b770cefbf91ebee8917aac5c20483bc2d80a6c3a04df32", size = 1629419, upload-time = "2025-01-29T05:37:06.642Z" }, - { url = "https://files.pythonhosted.org/packages/b4/02/0bde0485146a8a5e694daed47561785e8b77a0466ccc1f3e485d5ef2925e/black-25.1.0-cp310-cp310-macosx_11_0_arm64.whl", hash = "sha256:0e519ecf93120f34243e6b0054db49c00a35f84f195d5bce7e9f5cfc578fc2da", size = 1461080, upload-time = "2025-01-29T05:37:09.321Z" }, - { url = "https://files.pythonhosted.org/packages/52/0e/abdf75183c830eaca7589144ff96d49bce73d7ec6ad12ef62185cc0f79a2/black-25.1.0-cp310-cp310-manylinux_2_17_x86_64.manylinux2014_x86_64.manylinux_2_28_x86_64.whl", hash = "sha256:055e59b198df7ac0b7efca5ad7ff2516bca343276c466be72eb04a3bcc1f82d7", size = 1766886, upload-time = "2025-01-29T04:18:24.432Z" }, - { url = "https://files.pythonhosted.org/packages/dc/a6/97d8bb65b1d8a41f8a6736222ba0a334db7b7b77b8023ab4568288f23973/black-25.1.0-cp310-cp310-win_amd64.whl", hash = "sha256:db8ea9917d6f8fc62abd90d944920d95e73c83a5ee3383493e35d271aca872e9", size = 1419404, upload-time = "2025-01-29T04:19:04.296Z" }, - { url = "https://files.pythonhosted.org/packages/7e/4f/87f596aca05c3ce5b94b8663dbfe242a12843caaa82dd3f85f1ffdc3f177/black-25.1.0-cp311-cp311-macosx_10_9_x86_64.whl", hash = "sha256:a39337598244de4bae26475f77dda852ea00a93bd4c728e09eacd827ec929df0", size = 1614372, upload-time = "2025-01-29T05:37:11.71Z" }, - { url = "https://files.pythonhosted.org/packages/e7/d0/2c34c36190b741c59c901e56ab7f6e54dad8df05a6272a9747ecef7c6036/black-25.1.0-cp311-cp311-macosx_11_0_arm64.whl", hash = "sha256:96c1c7cd856bba8e20094e36e0f948718dc688dba4a9d78c3adde52b9e6c2299", size = 1442865, upload-time = "2025-01-29T05:37:14.309Z" }, - { url = "https://files.pythonhosted.org/packages/21/d4/7518c72262468430ead45cf22bd86c883a6448b9eb43672765d69a8f1248/black-25.1.0-cp311-cp311-manylinux_2_17_x86_64.manylinux2014_x86_64.manylinux_2_28_x86_64.whl", hash = "sha256:bce2e264d59c91e52d8000d507eb20a9aca4a778731a08cfff7e5ac4a4bb7096", size = 1749699, upload-time = "2025-01-29T04:18:17.688Z" }, - { url = "https://files.pythonhosted.org/packages/58/db/4f5beb989b547f79096e035c4981ceb36ac2b552d0ac5f2620e941501c99/black-25.1.0-cp311-cp311-win_amd64.whl", hash = "sha256:172b1dbff09f86ce6f4eb8edf9dede08b1fce58ba194c87d7a4f1a5aa2f5b3c2", size = 1428028, upload-time = "2025-01-29T04:18:51.711Z" }, - { url = "https://files.pythonhosted.org/packages/83/71/3fe4741df7adf015ad8dfa082dd36c94ca86bb21f25608eb247b4afb15b2/black-25.1.0-cp312-cp312-macosx_10_13_x86_64.whl", hash = "sha256:4b60580e829091e6f9238c848ea6750efed72140b91b048770b64e74fe04908b", size = 1650988, upload-time = "2025-01-29T05:37:16.707Z" }, - { url = "https://files.pythonhosted.org/packages/13/f3/89aac8a83d73937ccd39bbe8fc6ac8860c11cfa0af5b1c96d081facac844/black-25.1.0-cp312-cp312-macosx_11_0_arm64.whl", hash = "sha256:1e2978f6df243b155ef5fa7e558a43037c3079093ed5d10fd84c43900f2d8ecc", size = 1453985, upload-time = "2025-01-29T05:37:18.273Z" }, - { url = "https://files.pythonhosted.org/packages/6f/22/b99efca33f1f3a1d2552c714b1e1b5ae92efac6c43e790ad539a163d1754/black-25.1.0-cp312-cp312-manylinux_2_17_x86_64.manylinux2014_x86_64.manylinux_2_28_x86_64.whl", hash = "sha256:3b48735872ec535027d979e8dcb20bf4f70b5ac75a8ea99f127c106a7d7aba9f", size = 1783816, upload-time = "2025-01-29T04:18:33.823Z" }, - { url = "https://files.pythonhosted.org/packages/18/7e/a27c3ad3822b6f2e0e00d63d58ff6299a99a5b3aee69fa77cd4b0076b261/black-25.1.0-cp312-cp312-win_amd64.whl", hash = "sha256:ea0213189960bda9cf99be5b8c8ce66bb054af5e9e861249cd23471bd7b0b3ba", size = 1440860, upload-time = "2025-01-29T04:19:12.944Z" }, - { url = "https://files.pythonhosted.org/packages/98/87/0edf98916640efa5d0696e1abb0a8357b52e69e82322628f25bf14d263d1/black-25.1.0-cp313-cp313-macosx_10_13_x86_64.whl", hash = "sha256:8f0b18a02996a836cc9c9c78e5babec10930862827b1b724ddfe98ccf2f2fe4f", size = 1650673, upload-time = "2025-01-29T05:37:20.574Z" }, - { url = "https://files.pythonhosted.org/packages/52/e5/f7bf17207cf87fa6e9b676576749c6b6ed0d70f179a3d812c997870291c3/black-25.1.0-cp313-cp313-macosx_11_0_arm64.whl", hash = "sha256:afebb7098bfbc70037a053b91ae8437c3857482d3a690fefc03e9ff7aa9a5fd3", size = 1453190, upload-time = "2025-01-29T05:37:22.106Z" }, - { url = "https://files.pythonhosted.org/packages/e3/ee/adda3d46d4a9120772fae6de454c8495603c37c4c3b9c60f25b1ab6401fe/black-25.1.0-cp313-cp313-manylinux_2_17_x86_64.manylinux2014_x86_64.manylinux_2_28_x86_64.whl", hash = "sha256:030b9759066a4ee5e5aca28c3c77f9c64789cdd4de8ac1df642c40b708be6171", size = 1782926, upload-time = "2025-01-29T04:18:58.564Z" }, - { url = "https://files.pythonhosted.org/packages/cc/64/94eb5f45dcb997d2082f097a3944cfc7fe87e071907f677e80788a2d7b7a/black-25.1.0-cp313-cp313-win_amd64.whl", hash = "sha256:a22f402b410566e2d1c950708c77ebf5ebd5d0d88a6a2e87c86d9fb48afa0d18", size = 1442613, upload-time = "2025-01-29T04:19:27.63Z" }, - { url = "https://files.pythonhosted.org/packages/09/71/54e999902aed72baf26bca0d50781b01838251a462612966e9fc4891eadd/black-25.1.0-py3-none-any.whl", hash = "sha256:95e8176dae143ba9097f351d174fdaf0ccd29efb414b362ae3fd72bf0f710717", size = 207646, upload-time = "2025-01-29T04:15:38.082Z" }, -] - [[package]] name = "brotli" version = "1.1.0" @@ -1015,7 +981,7 @@ version = "3.24.0" source = { registry = "https://pypi.org/simple" } dependencies = [ { name = "attrs" }, - { name = "docstring-parser", marker = "python_full_version < '4.0'" }, + { name = "docstring-parser", marker = "python_full_version < '4'" }, { name = "rich" }, { name = "rich-rst" }, { name = "typing-extensions", marker = "python_full_version < '3.11'" }, @@ -1309,20 +1275,6 @@ wheels = [ { url = "https://files.pythonhosted.org/packages/7e/28/27f27d66eb82f24e6595deb26c0a875e62431878c416e38eac515023abb2/fitz-0.0.1.dev2-py2.py3-none-any.whl", hash = "sha256:3b75083d58068d9bd51695eb2f78c9c92094cd6c8dada839e93edcddf18c0c5c", size = 20003, upload-time = "2017-02-25T23:29:54.403Z" }, ] -[[package]] -name = "flake8" -version = "7.3.0" -source = { registry = "https://pypi.org/simple" } -dependencies = [ - { name = "mccabe" }, - { name = "pycodestyle" }, - { name = "pyflakes" }, -] -sdist = { url = "https://files.pythonhosted.org/packages/9b/af/fbfe3c4b5a657d79e5c47a2827a362f9e1b763336a52f926126aa6dc7123/flake8-7.3.0.tar.gz", hash = "sha256:fe044858146b9fc69b551a4b490d69cf960fcb78ad1edcb84e7fbb1b4a8e3872", size = 48326, upload-time = "2025-06-20T19:31:35.838Z" } -wheels = [ - { url = "https://files.pythonhosted.org/packages/9f/56/13ab06b4f93ca7cac71078fbe37fcea175d3216f31f85c3168a6bbd0bb9a/flake8-7.3.0-py2.py3-none-any.whl", hash = "sha256:b9696257b9ce8beb888cdbe31cf885c90d31928fe202be0889a7cdafad32f01e", size = 57922, upload-time = "2025-06-20T19:31:34.425Z" }, -] - [[package]] name = "flask" version = "2.1.3" @@ -2760,15 +2712,6 @@ wheels = [ { url = "https://files.pythonhosted.org/packages/16/53/8d8fa0ea32a8c8239e04d022f6c059ee5e1b77517769feccd50f1df43d6d/matplotlib-3.10.6-pp311-pypy311_pp73-manylinux2014_x86_64.manylinux_2_17_x86_64.whl", hash = "sha256:4d6ca6ef03dfd269f4ead566ec6f3fb9becf8dab146fb999022ed85ee9f6b3eb", size = 8693933, upload-time = "2025-08-30T00:14:22.942Z" }, ] -[[package]] -name = "mccabe" -version = "0.7.0" -source = { registry = "https://pypi.org/simple" } -sdist = { url = "https://files.pythonhosted.org/packages/e7/ff/0ffefdcac38932a54d2b5eed4e0ba8a408f215002cd178ad1df0f2806ff8/mccabe-0.7.0.tar.gz", hash = "sha256:348e0240c33b60bbdf4e523192ef919f28cb2c3d7d5c7794f74009290f236325", size = 9658, upload-time = "2022-01-24T01:14:51.113Z" } -wheels = [ - { url = "https://files.pythonhosted.org/packages/27/1a/1f68f9ba0c207934b35b86a8ca3aad8395a3d6dd7921c0686e23853ff5a9/mccabe-0.7.0-py2.py3-none-any.whl", hash = "sha256:6c2d30ab6be0e4a46919781807b4f0d834ebdd6c6e3dca0bda5a15f863427b6e", size = 7350, upload-time = "2022-01-24T01:14:49.62Z" }, -] - [[package]] name = "mcp" version = "1.14.0" @@ -3568,15 +3511,6 @@ wheels = [ { url = "https://files.pythonhosted.org/packages/78/f9/690a8600b93c332de3ab4a344a4ac34f00c8f104917061f779db6a918ed6/pathlib-1.0.1-py3-none-any.whl", hash = "sha256:f35f95ab8b0f59e6d354090350b44a80a80635d22efdedfa84c7ad1cf0a74147", size = 14363, upload-time = "2022-05-04T13:37:20.585Z" }, ] -[[package]] -name = "pathspec" -version = "0.12.1" -source = { registry = "https://pypi.org/simple" } -sdist = { url = "https://files.pythonhosted.org/packages/ca/bc/f35b8446f4531a7cb215605d100cd88b7ac6f44ab3fc94870c120ab3adbf/pathspec-0.12.1.tar.gz", hash = "sha256:a482d51503a1ab33b1c67a6c3813a26953dbdc71c31dacaef9a838c4e29f5712", size = 51043, upload-time = "2023-12-10T22:30:45Z" } -wheels = [ - { url = "https://files.pythonhosted.org/packages/cc/20/ff623b09d963f88bfde16306a54e12ee5ea43e9b597108672ff3a408aad6/pathspec-0.12.1-py3-none-any.whl", hash = "sha256:a0d503e138a4c123b27490a4f7beda6a01c6f288df0e4a8b79c7eb0dc7b4cc08", size = 31191, upload-time = "2023-12-10T22:30:43.14Z" }, -] - [[package]] name = "pdfminer-six" version = "20250506" @@ -3999,15 +3933,6 @@ wheels = [ { url = "https://files.pythonhosted.org/packages/47/8d/d529b5d697919ba8c11ad626e835d4039be708a35b0d22de83a269a6682c/pyasn1_modules-0.4.2-py3-none-any.whl", hash = "sha256:29253a9207ce32b64c3ac6600edc75368f98473906e8fd1043bd6b5b1de2c14a", size = 181259, upload-time = "2025-03-28T02:41:19.028Z" }, ] -[[package]] -name = "pycodestyle" -version = "2.14.0" -source = { registry = "https://pypi.org/simple" } -sdist = { url = "https://files.pythonhosted.org/packages/11/e0/abfd2a0d2efe47670df87f3e3a0e2edda42f055053c85361f19c0e2c1ca8/pycodestyle-2.14.0.tar.gz", hash = "sha256:c4b5b517d278089ff9d0abdec919cd97262a3367449ea1c8b49b91529167b783", size = 39472, upload-time = "2025-06-20T18:49:48.75Z" } -wheels = [ - { url = "https://files.pythonhosted.org/packages/d7/27/a58ddaf8c588a3ef080db9d0b7e0b97215cee3a45df74f3a94dbbf5c893a/pycodestyle-2.14.0-py2.py3-none-any.whl", hash = "sha256:dd6bf7cb4ee77f8e016f9c8e74a35ddd9f67e1d5fd4184d86c3b98e07099f42d", size = 31594, upload-time = "2025-06-20T18:49:47.491Z" }, -] - [[package]] name = "pycparser" version = "2.23" @@ -4189,15 +4114,6 @@ wheels = [ { url = "https://files.pythonhosted.org/packages/9b/4d/b9add7c84060d4c1906abe9a7e5359f2a60f7a9a4f67268b2766673427d8/pyee-13.0.0-py3-none-any.whl", hash = "sha256:48195a3cddb3b1515ce0695ed76036b5ccc2ef3a9f963ff9f77aec0139845498", size = 15730, upload-time = "2025-03-17T18:53:14.532Z" }, ] -[[package]] -name = "pyflakes" -version = "3.4.0" -source = { registry = "https://pypi.org/simple" } -sdist = { url = "https://files.pythonhosted.org/packages/45/dc/fd034dc20b4b264b3d015808458391acbf9df40b1e54750ef175d39180b1/pyflakes-3.4.0.tar.gz", hash = "sha256:b24f96fafb7d2ab0ec5075b7350b3d2d2218eab42003821c06344973d3ea2f58", size = 64669, upload-time = "2025-06-20T18:45:27.834Z" } -wheels = [ - { url = "https://files.pythonhosted.org/packages/c2/2f/81d580a0fb83baeb066698975cb14a618bdbed7720678566f1b046a95fe8/pyflakes-3.4.0-py2.py3-none-any.whl", hash = "sha256:f742a7dbd0d9cb9ea41e9a24a918996e8170c799fa528688d40dd582c8265f4f", size = 63551, upload-time = "2025-06-20T18:45:26.937Z" }, -] - [[package]] name = "pygments" version = "2.19.2" @@ -4945,28 +4861,28 @@ wheels = [ [[package]] name = "ruff" -version = "0.14.4" -source = { registry = "https://pypi.org/simple" } -sdist = { url = "https://files.pythonhosted.org/packages/df/55/cccfca45157a2031dcbb5a462a67f7cf27f8b37d4b3b1cd7438f0f5c1df6/ruff-0.14.4.tar.gz", hash = "sha256:f459a49fe1085a749f15414ca76f61595f1a2cc8778ed7c279b6ca2e1fd19df3", size = 5587844, upload-time = "2025-11-06T22:07:45.033Z" } -wheels = [ - { url = "https://files.pythonhosted.org/packages/17/b9/67240254166ae1eaa38dec32265e9153ac53645a6c6670ed36ad00722af8/ruff-0.14.4-py3-none-linux_armv6l.whl", hash = "sha256:e6604613ffbcf2297cd5dcba0e0ac9bd0c11dc026442dfbb614504e87c349518", size = 12606781, upload-time = "2025-11-06T22:07:01.841Z" }, - { url = "https://files.pythonhosted.org/packages/46/c8/09b3ab245d8652eafe5256ab59718641429f68681ee713ff06c5c549f156/ruff-0.14.4-py3-none-macosx_10_12_x86_64.whl", hash = "sha256:d99c0b52b6f0598acede45ee78288e5e9b4409d1ce7f661f0fa36d4cbeadf9a4", size = 12946765, upload-time = "2025-11-06T22:07:05.858Z" }, - { url = "https://files.pythonhosted.org/packages/14/bb/1564b000219144bf5eed2359edc94c3590dd49d510751dad26202c18a17d/ruff-0.14.4-py3-none-macosx_11_0_arm64.whl", hash = "sha256:9358d490ec030f1b51d048a7fd6ead418ed0826daf6149e95e30aa67c168af33", size = 11928120, upload-time = "2025-11-06T22:07:08.023Z" }, - { url = "https://files.pythonhosted.org/packages/a3/92/d5f1770e9988cc0742fefaa351e840d9aef04ec24ae1be36f333f96d5704/ruff-0.14.4-py3-none-manylinux_2_17_aarch64.manylinux2014_aarch64.whl", hash = "sha256:81b40d27924f1f02dfa827b9c0712a13c0e4b108421665322218fc38caf615c2", size = 12370877, upload-time = "2025-11-06T22:07:10.015Z" }, - { url = "https://files.pythonhosted.org/packages/e2/29/e9282efa55f1973d109faf839a63235575519c8ad278cc87a182a366810e/ruff-0.14.4-py3-none-manylinux_2_17_armv7l.manylinux2014_armv7l.whl", hash = "sha256:f5e649052a294fe00818650712083cddc6cc02744afaf37202c65df9ea52efa5", size = 12408538, upload-time = "2025-11-06T22:07:13.085Z" }, - { url = "https://files.pythonhosted.org/packages/8e/01/930ed6ecfce130144b32d77d8d69f5c610e6d23e6857927150adf5d7379a/ruff-0.14.4-py3-none-manylinux_2_17_i686.manylinux2014_i686.whl", hash = "sha256:aa082a8f878deeba955531f975881828fd6afd90dfa757c2b0808aadb437136e", size = 13141942, upload-time = "2025-11-06T22:07:15.386Z" }, - { url = "https://files.pythonhosted.org/packages/6a/46/a9c89b42b231a9f487233f17a89cbef9d5acd538d9488687a02ad288fa6b/ruff-0.14.4-py3-none-manylinux_2_17_ppc64.manylinux2014_ppc64.whl", hash = "sha256:1043c6811c2419e39011890f14d0a30470f19d47d197c4858b2787dfa698f6c8", size = 14544306, upload-time = "2025-11-06T22:07:17.631Z" }, - { url = "https://files.pythonhosted.org/packages/78/96/9c6cf86491f2a6d52758b830b89b78c2ae61e8ca66b86bf5a20af73d20e6/ruff-0.14.4-py3-none-manylinux_2_17_ppc64le.manylinux2014_ppc64le.whl", hash = "sha256:a9f3a936ac27fb7c2a93e4f4b943a662775879ac579a433291a6f69428722649", size = 14210427, upload-time = "2025-11-06T22:07:19.832Z" }, - { url = "https://files.pythonhosted.org/packages/71/f4/0666fe7769a54f63e66404e8ff698de1dcde733e12e2fd1c9c6efb689cb5/ruff-0.14.4-py3-none-manylinux_2_17_s390x.manylinux2014_s390x.whl", hash = "sha256:95643ffd209ce78bc113266b88fba3d39e0461f0cbc8b55fb92505030fb4a850", size = 13658488, upload-time = "2025-11-06T22:07:22.32Z" }, - { url = "https://files.pythonhosted.org/packages/ee/79/6ad4dda2cfd55e41ac9ed6d73ef9ab9475b1eef69f3a85957210c74ba12c/ruff-0.14.4-py3-none-manylinux_2_17_x86_64.manylinux2014_x86_64.whl", hash = "sha256:456daa2fa1021bc86ca857f43fe29d5d8b3f0e55e9f90c58c317c1dcc2afc7b5", size = 13354908, upload-time = "2025-11-06T22:07:24.347Z" }, - { url = "https://files.pythonhosted.org/packages/b5/60/f0b6990f740bb15c1588601d19d21bcc1bd5de4330a07222041678a8e04f/ruff-0.14.4-py3-none-manylinux_2_31_riscv64.whl", hash = "sha256:f911bba769e4a9f51af6e70037bb72b70b45a16db5ce73e1f72aefe6f6d62132", size = 13587803, upload-time = "2025-11-06T22:07:26.327Z" }, - { url = "https://files.pythonhosted.org/packages/c9/da/eaaada586f80068728338e0ef7f29ab3e4a08a692f92eb901a4f06bbff24/ruff-0.14.4-py3-none-musllinux_1_2_aarch64.whl", hash = "sha256:76158a7369b3979fa878612c623a7e5430c18b2fd1c73b214945c2d06337db67", size = 12279654, upload-time = "2025-11-06T22:07:28.46Z" }, - { url = "https://files.pythonhosted.org/packages/66/d4/b1d0e82cf9bf8aed10a6d45be47b3f402730aa2c438164424783ac88c0ed/ruff-0.14.4-py3-none-musllinux_1_2_armv7l.whl", hash = "sha256:f3b8f3b442d2b14c246e7aeca2e75915159e06a3540e2f4bed9f50d062d24469", size = 12357520, upload-time = "2025-11-06T22:07:31.468Z" }, - { url = "https://files.pythonhosted.org/packages/04/f4/53e2b42cc82804617e5c7950b7079d79996c27e99c4652131c6a1100657f/ruff-0.14.4-py3-none-musllinux_1_2_i686.whl", hash = "sha256:c62da9a06779deecf4d17ed04939ae8b31b517643b26370c3be1d26f3ef7dbde", size = 12719431, upload-time = "2025-11-06T22:07:33.831Z" }, - { url = "https://files.pythonhosted.org/packages/a2/94/80e3d74ed9a72d64e94a7b7706b1c1ebaa315ef2076fd33581f6a1cd2f95/ruff-0.14.4-py3-none-musllinux_1_2_x86_64.whl", hash = "sha256:5a443a83a1506c684e98acb8cb55abaf3ef725078be40237463dae4463366349", size = 13464394, upload-time = "2025-11-06T22:07:35.905Z" }, - { url = "https://files.pythonhosted.org/packages/54/1a/a49f071f04c42345c793d22f6cf5e0920095e286119ee53a64a3a3004825/ruff-0.14.4-py3-none-win32.whl", hash = "sha256:643b69cb63cd996f1fc7229da726d07ac307eae442dd8974dbc7cf22c1e18fff", size = 12493429, upload-time = "2025-11-06T22:07:38.43Z" }, - { url = "https://files.pythonhosted.org/packages/bc/22/e58c43e641145a2b670328fb98bc384e20679b5774258b1e540207580266/ruff-0.14.4-py3-none-win_amd64.whl", hash = "sha256:26673da283b96fe35fa0c939bf8411abec47111644aa9f7cfbd3c573fb125d2c", size = 13635380, upload-time = "2025-11-06T22:07:40.496Z" }, - { url = "https://files.pythonhosted.org/packages/30/bd/4168a751ddbbf43e86544b4de8b5c3b7be8d7167a2a5cb977d274e04f0a1/ruff-0.14.4-py3-none-win_arm64.whl", hash = "sha256:dd09c292479596b0e6fec8cd95c65c3a6dc68e9ad17b8f2382130f87ff6a75bb", size = 12663065, upload-time = "2025-11-06T22:07:42.603Z" }, +version = "0.14.6" +source = { registry = "https://pypi.org/simple" } +sdist = { url = "https://files.pythonhosted.org/packages/52/f0/62b5a1a723fe183650109407fa56abb433b00aa1c0b9ba555f9c4efec2c6/ruff-0.14.6.tar.gz", hash = "sha256:6f0c742ca6a7783a736b867a263b9a7a80a45ce9bee391eeda296895f1b4e1cc", size = 5669501, upload-time = "2025-11-21T14:26:17.903Z" } +wheels = [ + { url = "https://files.pythonhosted.org/packages/67/d2/7dd544116d107fffb24a0064d41a5d2ed1c9d6372d142f9ba108c8e39207/ruff-0.14.6-py3-none-linux_armv6l.whl", hash = "sha256:d724ac2f1c240dbd01a2ae98db5d1d9a5e1d9e96eba999d1c48e30062df578a3", size = 13326119, upload-time = "2025-11-21T14:25:24.2Z" }, + { url = "https://files.pythonhosted.org/packages/36/6a/ad66d0a3315d6327ed6b01f759d83df3c4d5f86c30462121024361137b6a/ruff-0.14.6-py3-none-macosx_10_12_x86_64.whl", hash = "sha256:9f7539ea257aa4d07b7ce87aed580e485c40143f2473ff2f2b75aee003186004", size = 13526007, upload-time = "2025-11-21T14:25:26.906Z" }, + { url = "https://files.pythonhosted.org/packages/a3/9d/dae6db96df28e0a15dea8e986ee393af70fc97fd57669808728080529c37/ruff-0.14.6-py3-none-macosx_11_0_arm64.whl", hash = "sha256:7f6007e55b90a2a7e93083ba48a9f23c3158c433591c33ee2e99a49b889c6332", size = 12676572, upload-time = "2025-11-21T14:25:29.826Z" }, + { url = "https://files.pythonhosted.org/packages/76/a4/f319e87759949062cfee1b26245048e92e2acce900ad3a909285f9db1859/ruff-0.14.6-py3-none-manylinux_2_17_aarch64.manylinux2014_aarch64.whl", hash = "sha256:0a8e7b9d73d8728b68f632aa8e824ef041d068d231d8dbc7808532d3629a6bef", size = 13140745, upload-time = "2025-11-21T14:25:32.788Z" }, + { url = "https://files.pythonhosted.org/packages/95/d3/248c1efc71a0a8ed4e8e10b4b2266845d7dfc7a0ab64354afe049eaa1310/ruff-0.14.6-py3-none-manylinux_2_17_armv7l.manylinux2014_armv7l.whl", hash = "sha256:d50d45d4553a3ebcbd33e7c5e0fe6ca4aafd9a9122492de357205c2c48f00775", size = 13076486, upload-time = "2025-11-21T14:25:35.601Z" }, + { url = "https://files.pythonhosted.org/packages/a5/19/b68d4563fe50eba4b8c92aa842149bb56dd24d198389c0ed12e7faff4f7d/ruff-0.14.6-py3-none-manylinux_2_17_i686.manylinux2014_i686.whl", hash = "sha256:118548dd121f8a21bfa8ab2c5b80e5b4aed67ead4b7567790962554f38e598ce", size = 13727563, upload-time = "2025-11-21T14:25:38.514Z" }, + { url = "https://files.pythonhosted.org/packages/47/ac/943169436832d4b0e867235abbdb57ce3a82367b47e0280fa7b4eabb7593/ruff-0.14.6-py3-none-manylinux_2_17_ppc64.manylinux2014_ppc64.whl", hash = "sha256:57256efafbfefcb8748df9d1d766062f62b20150691021f8ab79e2d919f7c11f", size = 15199755, upload-time = "2025-11-21T14:25:41.516Z" }, + { url = "https://files.pythonhosted.org/packages/c9/b9/288bb2399860a36d4bb0541cb66cce3c0f4156aaff009dc8499be0c24bf2/ruff-0.14.6-py3-none-manylinux_2_17_ppc64le.manylinux2014_ppc64le.whl", hash = "sha256:ff18134841e5c68f8e5df1999a64429a02d5549036b394fafbe410f886e1989d", size = 14850608, upload-time = "2025-11-21T14:25:44.428Z" }, + { url = "https://files.pythonhosted.org/packages/ee/b1/a0d549dd4364e240f37e7d2907e97ee80587480d98c7799d2d8dc7a2f605/ruff-0.14.6-py3-none-manylinux_2_17_s390x.manylinux2014_s390x.whl", hash = "sha256:29c4b7ec1e66a105d5c27bd57fa93203637d66a26d10ca9809dc7fc18ec58440", size = 14118754, upload-time = "2025-11-21T14:25:47.214Z" }, + { url = "https://files.pythonhosted.org/packages/13/ac/9b9fe63716af8bdfddfacd0882bc1586f29985d3b988b3c62ddce2e202c3/ruff-0.14.6-py3-none-manylinux_2_17_x86_64.manylinux2014_x86_64.whl", hash = "sha256:167843a6f78680746d7e226f255d920aeed5e4ad9c03258094a2d49d3028b105", size = 13949214, upload-time = "2025-11-21T14:25:50.002Z" }, + { url = "https://files.pythonhosted.org/packages/12/27/4dad6c6a77fede9560b7df6802b1b697e97e49ceabe1f12baf3ea20862e9/ruff-0.14.6-py3-none-manylinux_2_31_riscv64.whl", hash = "sha256:16a33af621c9c523b1ae006b1b99b159bf5ac7e4b1f20b85b2572455018e0821", size = 14106112, upload-time = "2025-11-21T14:25:52.841Z" }, + { url = "https://files.pythonhosted.org/packages/6a/db/23e322d7177873eaedea59a7932ca5084ec5b7e20cb30f341ab594130a71/ruff-0.14.6-py3-none-musllinux_1_2_aarch64.whl", hash = "sha256:1432ab6e1ae2dc565a7eea707d3b03a0c234ef401482a6f1621bc1f427c2ff55", size = 13035010, upload-time = "2025-11-21T14:25:55.536Z" }, + { url = "https://files.pythonhosted.org/packages/a8/9c/20e21d4d69dbb35e6a1df7691e02f363423658a20a2afacf2a2c011800dc/ruff-0.14.6-py3-none-musllinux_1_2_armv7l.whl", hash = "sha256:4c55cfbbe7abb61eb914bfd20683d14cdfb38a6d56c6c66efa55ec6570ee4e71", size = 13054082, upload-time = "2025-11-21T14:25:58.625Z" }, + { url = "https://files.pythonhosted.org/packages/66/25/906ee6a0464c3125c8d673c589771a974965c2be1a1e28b5c3b96cb6ef88/ruff-0.14.6-py3-none-musllinux_1_2_i686.whl", hash = "sha256:efea3c0f21901a685fff4befda6d61a1bf4cb43de16da87e8226a281d614350b", size = 13303354, upload-time = "2025-11-21T14:26:01.816Z" }, + { url = "https://files.pythonhosted.org/packages/4c/58/60577569e198d56922b7ead07b465f559002b7b11d53f40937e95067ca1c/ruff-0.14.6-py3-none-musllinux_1_2_x86_64.whl", hash = "sha256:344d97172576d75dc6afc0e9243376dbe1668559c72de1864439c4fc95f78185", size = 14054487, upload-time = "2025-11-21T14:26:05.058Z" }, + { url = "https://files.pythonhosted.org/packages/67/0b/8e4e0639e4cc12547f41cb771b0b44ec8225b6b6a93393176d75fe6f7d40/ruff-0.14.6-py3-none-win32.whl", hash = "sha256:00169c0c8b85396516fdd9ce3446c7ca20c2a8f90a77aa945ba6b8f2bfe99e85", size = 13013361, upload-time = "2025-11-21T14:26:08.152Z" }, + { url = "https://files.pythonhosted.org/packages/fb/02/82240553b77fd1341f80ebb3eaae43ba011c7a91b4224a9f317d8e6591af/ruff-0.14.6-py3-none-win_amd64.whl", hash = "sha256:390e6480c5e3659f8a4c8d6a0373027820419ac14fa0d2713bd8e6c3e125b8b9", size = 14432087, upload-time = "2025-11-21T14:26:10.891Z" }, + { url = "https://files.pythonhosted.org/packages/a5/1f/93f9b0fad9470e4c829a5bb678da4012f0c710d09331b860ee555216f4ea/ruff-0.14.6-py3-none-win_arm64.whl", hash = "sha256:d43c81fbeae52cfa8728d8766bbf46ee4298c888072105815b392da70ca836b2", size = 13520930, upload-time = "2025-11-21T14:26:13.951Z" }, ] [[package]] @@ -5686,7 +5602,7 @@ wheels = [ [[package]] name = "tooluniverse" -version = "1.0.13.1" +version = "1.0.14" source = { editable = "." } dependencies = [ { name = "aiohttp" }, @@ -5714,10 +5630,12 @@ dependencies = [ { name = "playwright" }, { name = "psutil" }, { name = "pydantic" }, + { name = "python-dotenv" }, { name = "pyyaml" }, { name = "rcsb-api" }, { name = "requests" }, { name = "setuptools" }, + { name = "sympy" }, { name = "uvicorn" }, { name = "xmltodict" }, ] @@ -5725,9 +5643,7 @@ dependencies = [ [package.optional-dependencies] all = [ { name = "admet-ai" }, - { name = "black" }, { name = "faiss-cpu" }, - { name = "flake8" }, { name = "flask" }, { name = "furo" }, { name = "huggingface-hub" }, @@ -5754,6 +5670,7 @@ all = [ { name = "rdkit" }, { name = "requests" }, { name = "requests-mock" }, + { name = "ruff" }, { name = "scipy" }, { name = "sentence-transformers" }, { name = "shibuya" }, @@ -5771,8 +5688,6 @@ build = [ { name = "pyinstaller" }, ] dev = [ - { name = "black" }, - { name = "flake8" }, { name = "pre-commit" }, { name = "pytest" }, { name = "pytest-asyncio" }, @@ -5782,6 +5697,7 @@ dev = [ { name = "pytest-timeout" }, { name = "pytest-xdist" }, { name = "requests-mock" }, + { name = "ruff" }, ] docs = [ { name = "furo" }, @@ -5848,7 +5764,6 @@ requires-dist = [ { name = "admet-ai", marker = "extra == 'ml'", specifier = ">=1.2.0" }, { name = "aiohttp" }, { name = "beautifulsoup4", specifier = ">=4.12.0" }, - { name = "black", marker = "extra == 'dev'", specifier = ">=22.0" }, { name = "ddgs", specifier = ">=9.0.0" }, { name = "epam-indigo", specifier = ">=1.34.0" }, { name = "faiss-cpu", specifier = ">=1.12.0" }, @@ -5857,7 +5772,6 @@ requires-dist = [ { name = "fastapi", specifier = ">=0.116.0" }, { name = "fastmcp", specifier = ">=2.12.0" }, { name = "fitz", specifier = ">=0.0.1.dev2" }, - { name = "flake8", marker = "extra == 'dev'", specifier = ">=4.0" }, { name = "flask", specifier = ">=2.0.0" }, { name = "flask", marker = "extra == 'graph'", specifier = ">=2.0.0" }, { name = "furo", marker = "extra == 'docs'", specifier = ">=2024.8.6" }, @@ -5903,6 +5817,7 @@ requires-dist = [ { name = "pytest-mock", marker = "extra == 'dev'", specifier = ">=3.14.0" }, { name = "pytest-timeout", marker = "extra == 'dev'", specifier = ">=2.3.1" }, { name = "pytest-xdist", marker = "extra == 'dev'", specifier = ">=3.0" }, + { name = "python-dotenv", specifier = ">=1.0.0" }, { name = "pyyaml", specifier = ">=6.0.0" }, { name = "pyyaml", marker = "extra == 'space'", specifier = ">=6.0.0" }, { name = "rcsb-api", specifier = ">=1.4.0" }, @@ -5910,6 +5825,7 @@ requires-dist = [ { name = "requests", specifier = ">=2.32.0" }, { name = "requests", marker = "extra == 'space'", specifier = ">=2.32.0" }, { name = "requests-mock", marker = "extra == 'dev'", specifier = ">=1.12.1" }, + { name = "ruff", marker = "extra == 'dev'", specifier = ">=0.14.5" }, { name = "scipy", marker = "extra == 'graph'", specifier = ">=1.7.0" }, { name = "scipy", marker = "extra == 'visualization'", specifier = ">=1.7.0" }, { name = "sentence-transformers", marker = "extra == 'embedding'", specifier = ">=5.1.0" }, @@ -5925,6 +5841,7 @@ requires-dist = [ { name = "sphinx-notfound-page", marker = "extra == 'docs'", specifier = ">=0.8" }, { name = "sphinx-rtd-theme", marker = "extra == 'docs'", specifier = ">=1.0" }, { name = "sphinx-tabs", marker = "extra == 'docs'", specifier = ">=3.2.0" }, + { name = "sympy", specifier = ">=1.12.0" }, { name = "tooluniverse", extras = ["dev", "docs", "graph", "visualization", "space", "embedding", "ml"], marker = "extra == 'all'", editable = "." }, { name = "uvicorn", specifier = ">=0.35.0" }, { name = "werkzeug", marker = "extra == 'graph'", specifier = ">=2.0.0" },