invariant-science 0.1.0__tar.gz

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
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  1. invariant_science-0.1.0/.github/ISSUE_TEMPLATE/bug_report.md +26 -0
  2. invariant_science-0.1.0/.github/ISSUE_TEMPLATE/documentation.md +15 -0
  3. invariant_science-0.1.0/.github/ISSUE_TEMPLATE/feature_request.md +20 -0
  4. invariant_science-0.1.0/.github/workflows/ci.yml +88 -0
  5. invariant_science-0.1.0/CHANGELOG.md +74 -0
  6. invariant_science-0.1.0/CODE_OF_CONDUCT.md +7 -0
  7. invariant_science-0.1.0/CONTRIBUTING.md +50 -0
  8. invariant_science-0.1.0/LICENSE +202 -0
  9. invariant_science-0.1.0/MANIFEST.in +9 -0
  10. invariant_science-0.1.0/PKG-INFO +289 -0
  11. invariant_science-0.1.0/README.md +256 -0
  12. invariant_science-0.1.0/SECURITY.md +28 -0
  13. invariant_science-0.1.0/docs/API.md +251 -0
  14. invariant_science-0.1.0/docs/AUDIT_COMMANDS.md +204 -0
  15. invariant_science-0.1.0/docs/AUDIT_REPORT.md +269 -0
  16. invariant_science-0.1.0/docs/CI_TUTORIAL.md +55 -0
  17. invariant_science-0.1.0/docs/CLI.md +66 -0
  18. invariant_science-0.1.0/docs/DEVELOPER_EXPERIENCE_REVIEW.md +94 -0
  19. invariant_science-0.1.0/docs/DIFFERENTIATION.md +65 -0
  20. invariant_science-0.1.0/docs/FINAL_AUDIT.md +233 -0
  21. invariant_science-0.1.0/docs/FIRST_CONTRIBUTIONS.md +37 -0
  22. invariant_science-0.1.0/docs/KNOWN_LIMITATIONS.md +79 -0
  23. invariant_science-0.1.0/docs/LAUNCH_PLAN.md +48 -0
  24. invariant_science-0.1.0/docs/LIMITATIONS.md +52 -0
  25. invariant_science-0.1.0/docs/LOCAL_VALIDATION.md +39 -0
  26. invariant_science-0.1.0/docs/NAMESPACE_MIGRATION.md +28 -0
  27. invariant_science-0.1.0/docs/POISSON_CASE_STUDY.md +112 -0
  28. invariant_science-0.1.0/docs/PRIOR_ART.md +24 -0
  29. invariant_science-0.1.0/docs/QUICKSTART.md +58 -0
  30. invariant_science-0.1.0/docs/RELEASE_CHECKLIST.md +47 -0
  31. invariant_science-0.1.0/docs/SCIENTIFIC_VALIDATION.md +395 -0
  32. invariant_science-0.1.0/docs/V1_SPEC.md +65 -0
  33. invariant_science-0.1.0/docs/assets/invariant-banner.svg +41 -0
  34. invariant_science-0.1.0/docs/poisson-reports/boundary-offset.html +152 -0
  35. invariant_science-0.1.0/docs/poisson-reports/boundary-offset.json +309 -0
  36. invariant_science-0.1.0/docs/poisson-reports/dirichlet.html +132 -0
  37. invariant_science-0.1.0/docs/poisson-reports/dirichlet.json +289 -0
  38. invariant_science-0.1.0/examples/oscillator.py +27 -0
  39. invariant_science-0.1.0/examples/poisson.py +115 -0
  40. invariant_science-0.1.0/examples/quickstart.py +24 -0
  41. invariant_science-0.1.0/examples/test_verification.py +38 -0
  42. invariant_science-0.1.0/examples/verification-workflow.yml +32 -0
  43. invariant_science-0.1.0/pyproject.toml +56 -0
  44. invariant_science-0.1.0/setup.cfg +4 -0
  45. invariant_science-0.1.0/site/euler.html +185 -0
  46. invariant_science-0.1.0/site/euler.json +299 -0
  47. invariant_science-0.1.0/site/index.html +94 -0
  48. invariant_science-0.1.0/site/verlet.html +74 -0
  49. invariant_science-0.1.0/site/verlet.json +188 -0
  50. invariant_science-0.1.0/src/invariant_science/__init__.py +12 -0
  51. invariant_science-0.1.0/src/invariant_science/__main__.py +2 -0
  52. invariant_science-0.1.0/src/invariant_science/_version.py +3 -0
  53. invariant_science-0.1.0/src/invariant_science/checks.py +497 -0
  54. invariant_science-0.1.0/src/invariant_science/cli.py +211 -0
  55. invariant_science-0.1.0/src/invariant_science/models.py +200 -0
  56. invariant_science-0.1.0/src/invariant_science/physics.py +92 -0
  57. invariant_science-0.1.0/src/invariant_science/py.typed +0 -0
  58. invariant_science-0.1.0/src/invariant_science/reports.py +118 -0
  59. invariant_science-0.1.0/src/invariant_science.egg-info/PKG-INFO +289 -0
  60. invariant_science-0.1.0/src/invariant_science.egg-info/SOURCES.txt +79 -0
  61. invariant_science-0.1.0/src/invariant_science.egg-info/dependency_links.txt +1 -0
  62. invariant_science-0.1.0/src/invariant_science.egg-info/entry_points.txt +2 -0
  63. invariant_science-0.1.0/src/invariant_science.egg-info/requires.txt +15 -0
  64. invariant_science-0.1.0/src/invariant_science.egg-info/top_level.txt +1 -0
  65. invariant_science-0.1.0/tests/test_checks.py +130 -0
  66. invariant_science-0.1.0/tests/test_cli_regressions.py +276 -0
  67. invariant_science-0.1.0/tests/test_numerical_regressions.py +223 -0
  68. invariant_science-0.1.0/tests/test_physics_cli.py +60 -0
  69. invariant_science-0.1.0/tests/test_physics_regressions.py +52 -0
  70. invariant_science-0.1.0/tests/test_physics_scientific.py +135 -0
  71. invariant_science-0.1.0/tests/test_poisson_example.py +47 -0
  72. invariant_science-0.1.0/tests/test_release_boundaries.py +122 -0
  73. invariant_science-0.1.0/tests/test_report_completeness.py +47 -0
  74. invariant_science-0.1.0/tests/test_report_regressions.py +149 -0
  75. invariant_science-0.1.0/tests/test_reports.py +74 -0
  76. invariant_science-0.1.0/tests/test_residual_convergence.py +179 -0
  77. invariant_science-0.1.0/tests/test_scientific_contracts.py +172 -0
  78. invariant_science-0.1.0/tests/test_scientific_properties.py +98 -0
  79. invariant_science-0.1.0/tools/build_showcase.py +153 -0
  80. invariant_science-0.1.0/tools/check_distribution.py +90 -0
  81. invariant_science-0.1.0/tools/smoke_install.py +53 -0
@@ -0,0 +1,26 @@
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+ ---
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+ name: Bug report
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+ about: Report a reproducible defect
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+ labels: bug
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+ ---
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+
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+ For a vulnerability, use the private reporting route in `SECURITY.md`.
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+
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+ ### What did you expect?
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+
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+ State the check and why you expected it to pass, fail, or be inconclusive.
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+
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+ ### What happened?
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+
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+ Include the status, CLI exit code if relevant, and the relevant error or report
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+ excerpt. Remove secrets, private data, and identifying paths.
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+
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+ ### How can we reproduce it?
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+
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+ Paste the smallest runnable Python snippet or CLI commands and a synthetic
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+ input. Include array shapes and dtypes, tolerances, and any model assumptions.
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+
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+ ### Environment
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+
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+ Include the operating system, Python, NumPy, and `invariant-science --version` output,
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+ and whether you installed from source, a wheel, or an sdist.
@@ -0,0 +1,15 @@
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+ ---
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+ name: Documentation or installation problem
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+ about: Report a confusing instruction, example, or setup step
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+ labels: documentation
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+ ---
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+
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+ ### Where did you get stuck?
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+
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+ Link the page or give the command you ran. Include your operating system,
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+ Python version, and installation source.
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+
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+ ### What did you expect to happen?
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+
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+ Include the actual output or wording that led you to expect something else.
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+ Remove private paths, credentials, and data from examples.
@@ -0,0 +1,20 @@
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+ ---
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+ name: Scientific check request
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+ about: Propose a numerical or scientific property worth verifying
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+ labels: enhancement
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+ ---
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+
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+ ### What calculation needs this check?
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+
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+ Describe the computation, its output, and what your current workflow misses.
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+
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+ ### What property should hold?
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+
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+ State the equation or criterion, units, assumptions, and how you would choose
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+ tolerances. Link an analytical solution, reference implementation, or paper
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+ if available.
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+
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+ ### What should the report show?
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+
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+ Give one small example that should pass and one that should fail. Describe
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+ what would make a result inconclusive or misleading.
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+ name: CI
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+ on:
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+ push:
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+ pull_request:
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+ permissions:
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+ contents: read
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+ jobs:
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+ test:
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+ runs-on: ${{ matrix.os }}
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+ strategy:
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+ fail-fast: false
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+ matrix:
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+ os: [ubuntu-latest, windows-latest, macos-latest]
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+ python-version: ["3.11", "3.12", "3.13", "3.14"]
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+ steps:
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+ - uses: actions/checkout@v7
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+ with:
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+ persist-credentials: false
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+ - uses: actions/setup-python@v7
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+ with:
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+ python-version: ${{ matrix.python-version }}
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+ cache: pip
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+ - run: python -m pip install -e ".[dev]"
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+ - run: python -m pytest -q -W error --cov=invariant_science --cov-branch --cov-report=term-missing
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+ - run: python -m invariant_science demo --out reports/ci-demo
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+ lint:
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+ runs-on: ubuntu-latest
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+ steps:
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+ - uses: actions/checkout@v7
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+ with:
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+ persist-credentials: false
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+ - uses: actions/setup-python@v7
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+ with:
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+ python-version: "3.13"
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+ - run: python -m pip install -e ".[dev]"
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+ - run: ruff check src tests examples tools
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+ - run: python -m mypy src/invariant_science --check-untyped-defs
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+ tutorials:
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+ runs-on: ubuntu-latest
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+ steps:
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+ - uses: actions/checkout@v7
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+ with:
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+ persist-credentials: false
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+ - uses: actions/setup-python@v7
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+ with:
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+ python-version: "3.12"
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+ - run: python -m pip install . pytest
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+ - run: python examples/quickstart.py
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+ - run: python examples/oscillator.py
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+ - run: python examples/poisson.py
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+ - run: python tools/build_showcase.py --out reports/showcase
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+ - run: python -m pytest -q --tb=short examples/test_verification.py
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+ - name: Check that a numerical regression fails pytest and leaves reports
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+ env:
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+ INVARIANT_INJECT_REGRESSION: "1"
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+ run: |
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+ status=0
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+ python -m pytest -q --tb=short examples/test_verification.py || status=$?
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+ test "$status" -eq 1
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+ python -c 'import json; from pathlib import Path; assert json.loads(Path("reports/verification/position.json").read_text())["status"] == "FAIL"'
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+ - uses: actions/upload-artifact@v7
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+ if: ${{ !cancelled() }}
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+ with:
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+ name: tutorial-reports
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+ path: reports/
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+ package:
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+ runs-on: ubuntu-latest
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+ steps:
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+ - uses: actions/checkout@v7
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+ with:
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+ persist-credentials: false
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+ - uses: actions/setup-python@v7
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+ with:
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+ python-version: "3.11"
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+ - run: python -m pip install build "setuptools==77.0.3" wheel twine
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+ - run: python -m build --no-isolation
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+ - run: python tools/check_distribution.py dist
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+ - run: python -m twine check --strict dist/*
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+ - run: python -m venv .venv-wheel
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+ - run: .venv-wheel/bin/python -m pip install dist/*.whl "numpy==2.1.0"
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+ - run: .venv-wheel/bin/python -m pip check
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+ - run: .venv-wheel/bin/python -I tools/smoke_install.py
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+ - run: .venv-wheel/bin/python -m pip install "pytest>=8" "hypothesis>=6.100"
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+ - run: .venv-wheel/bin/python -I -m pytest -q -W error
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+ - run: python -m venv .venv-sdist
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+ - run: .venv-sdist/bin/python -m pip install dist/*.tar.gz
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+ - run: .venv-sdist/bin/python -m pip check
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+ - run: .venv-sdist/bin/python -I tools/smoke_install.py
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+ # Changelog
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+
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+ ## Unreleased — final release audit
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+
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+ - **Breaking preview migration:** replace the `invariant` import with
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+ `invariant_science` and the `invariant` command with `invariant-science`.
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+ Existing public packages own the old namespace and command. No compatibility
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+ alias is installed. The distribution remains `invariant-science`, version
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+ `0.1.0` (unpublished). See `docs/NAMESPACE_MIGRATION.md`.
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+ - Preserve report schema version 1 and its `environment.invariant` version key.
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+ - Add independent residual and convergence properties, malformed metadata and
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+ filesystem error regressions; run coverage and type checking in CI.
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+ - Record final release gates, evidence, and remaining limitations.
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+
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+ ## Unreleased — first public release preparation
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+
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+ - Add a five-minute quickstart, pytest regression examples, a copyable
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+ GitHub Actions workflow, and a generated PASS and FAIL showcase.
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+ - Add Python 3.11 and 3.12 to the package and CI matrix. Use NumPy 2.3.4
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+ as the minimum on Python 3.14 and keep NumPy 2.1 on Python 3.11–3.13.
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+ - Add CLI help and early report path validation. Identify the offending input
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+ on file errors and print the first failing coordinate when available.
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+ - Use one version source for packaging, the Python API, CLI, and new reports.
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+ Check wheel and sdist contents and smoke-test each installed artifact.
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+
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+ ## Unreleased — checks on existing computations
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+
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+ - Add residual and observed convergence checks with explicit acceptance
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+ criteria, standalone results, and JSON and HTML reporting.
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+ - Add the NumPy Poisson refinement case study with independent analytical
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+ tests, pass and fail reports, and a reproducible overhead measurement.
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+ - Compare the verification workflow with NumPy testing, pytest, Hypothesis,
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+ SciUnit and physverify in `docs/DIFFERENTIATION.md`.
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+
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+ ## Unreleased — scientific validation
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+
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+ - Specify every supported check, tolerance semantics, numerical limitations,
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+ status precedence and oscillator equations in `docs/SCIENTIFIC_VALIDATION.md`.
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+ - Reject boolean/text/masked/non-scalar tolerances and precision-losing tolerance
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+ conversions; reject booleans hidden in numeric sequences. Non-finite singleton
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+ conservation inputs now FAIL rather than being INCONCLUSIVE.
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+ - Add exact integer error magnitudes, worst-error locations, non-finite locations,
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+ zero-reference/relative-overflow/relative-underflow counts and matrix assumptions.
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+ - Preserve report status precedence and add completion/status counts to all
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+ formats, including explicit incomplete-verification messages.
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+ - Validate the oscillator against analytical solutions, discrete energy laws and
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+ convergence order; check analytical velocity in both demonstrations. Physics
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+ helpers now reject unsupported/non-finite/lossy inputs and overflowing outputs.
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+ - Add Hypothesis as a development dependency and rational/algebraic property
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+ tests. Existing rounded floating-point boundary semantics remain explicit;
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+ passing a tolerance check is not an exact real-arithmetic guarantee.
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+
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+ ## Unreleased — repository audit
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+
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+ - Prevent false PASS from lossy large-integer coercion, masked inputs and empty
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+ or invalid public report models; conservatively reject wider comparison dtypes.
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+ - Bound failure-coordinate and exact-integer temporary allocations.
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+ - Validate numeric NPY snapshots before construction, enforce configurable file
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+ limits, bind hashes to loaded bytes and normalize input errors to CLI exit 2.
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+ - Reject complex real-valued parameters and avoid avoidable energy overflow.
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+ - Reject lossy JSON object keys; include evidence in HTML/Markdown reports.
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+ - Correct the setuptools minimum, ship scientific docs in sdists, and add
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+ regression and artifact checks. See docs/AUDIT_REPORT.md for compatibility notes.
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+
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+ ## [0.1.0] — initial source preview (unpublished)
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+
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+ - Typed numerical check results and report statuses.
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+ - Strict-shape comparisons with numerical diagnostics.
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+ - Finite, symmetric, Hermitian and conservation checks.
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+ - Atomic JSON, HTML and Markdown report exports.
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+ - Ideal oscillator Euler vs Verlet demonstration.
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+ - Command-line demo and `.npy` comparison.
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+ - Initial tests, CI workflow, contributor guidance.
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+ - Analytical reference check in demo, CI assertion helper and CLI input hashes.
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+ # Community conduct
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+
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+ Be welcoming and respectful. Critique ideas and evidence rather than people.
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+ Do not engage in harassment, threats, discrimination or sharing private data.
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+ Report concerns privately to the maintainers through a secure GitHub contact
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+ channel once configured. Maintainers may remove harmful content or restrict
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+ participation. A named responsible contact must be configured before launch.
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+ # Contributing to INVARIANT
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+
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+ Start with the [five-minute quickstart](docs/QUICKSTART.md) and the
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+ [first contribution ideas](docs/FIRST_CONTRIBUTIONS.md). Search existing
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+ issues before opening one. Small documentation fixes and self-contained
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+ regressions can go straight to a pull request. Discuss new checks, API changes,
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+ or tolerance semantics in an issue first.
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+
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+ ## Set up the development environment
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+
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+ Use Python 3.11–3.14. Create a virtual environment as shown in the
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+ [quickstart](docs/QUICKSTART.md), then run these commands from the source folder.
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+
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+ ```sh
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+ python -m pip install -e ".[dev]"
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+ python -m pytest -q -W error --cov=invariant_science --cov-branch --cov-report=term-missing
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+ python -m ruff check src tests examples tools
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+ python -m mypy src/invariant_science --check-untyped-defs
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+ ```
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+
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+ On Windows, you can use `.venv\Scripts\python.exe` in place of `python`.
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+ Run a focused file with `python -m pytest -q tests/test_checks.py`.
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+
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+ - `src/invariant_science/` contains the checks, report models, exporters, and CLI.
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+ - `tests/` covers numerical contracts, input validation, and reports.
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+ - `examples/` contains standalone tutorials and the sample CI workflow.
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+ - `tools/build_showcase.py` rebuilds the offline showcase from CLI reports.
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+
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+ ## Submit a change
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+
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+ 1. Describe the observed behavior, expected result, and why the change is needed.
32
+ 2. For a scientific check, state the property, units, tolerance choice, and
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+ assumptions. Include a PASS case and a case that fails for the intended
34
+ reason. Use an analytical or independent reference when possible.
35
+ 3. Add or update focused regression tests and documentation. Run the affected
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+ examples and include the commands and results in the pull request.
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+ 4. Keep runtime dependencies minimal and use synthetic or redistributable inputs.
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+ Remove private data and secrets from reports before attaching them.
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+
40
+ For release checks, build into a fresh directory and inspect the artifacts.
41
+
42
+ ```sh
43
+ python -m build --outdir dist
44
+ python tools/check_distribution.py dist
45
+ python -m twine check --strict dist/*
46
+ ```
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+
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+ The [release checklist](docs/LAUNCH_PLAN.md#first-public-release-checklist)
49
+ covers fresh installs, version checks, and publication prerequisites. See the
50
+ [code of conduct](CODE_OF_CONDUCT.md) and [security policy](SECURITY.md).
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+
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+ Apache License
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+ Version 2.0, January 2004
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+ http://www.apache.org/licenses/
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+
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+ TERMS AND CONDITIONS FOR USE, REPRODUCTION, AND DISTRIBUTION
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@@ -0,0 +1,9 @@
1
+ include CHANGELOG.md CODE_OF_CONDUCT.md CONTRIBUTING.md SECURITY.md
2
+ include .github/workflows/ci.yml
3
+ recursive-include .github/ISSUE_TEMPLATE *.md
4
+ recursive-include docs *.md
5
+ recursive-include docs/assets *.svg
6
+ recursive-include docs/poisson-reports *.html *.json
7
+ recursive-include site *.html *.json
8
+ recursive-include examples *.py *.yml
9
+ recursive-include tools *.py