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@szl0072 szl0072 commented Mar 15, 2018

  1. Line 44 should have a ',' after the '--index';
  2. Remove indices= in line 96.

Slimygen and others added 30 commits May 12, 2025 19:59
…t-0.x

Update pre-commit hook astral-sh/ruff-pre-commit to v0.11.9
…igest

Update codecov/codecov-action digest to 18283e0
…t-0.x

Update pre-commit hook astral-sh/ruff-pre-commit to v0.11.10
lukas and others added 30 commits October 1, 2025 20:02
Serenity: Added natom, atomnos, atomcoords
Update pre-commit hook PyCQA/isort to v6.1.0
…t-0.x

Update pre-commit hook astral-sh/ruff-pre-commit to v0.13.3
…n-digest

Update cachix/install-nix-action digest to 9280e7a
Update pre-commit hook PyCQA/isort to v7
Co-authored-by: renovate[bot] <29139614+renovate[bot]@users.noreply.github.com>
Co-authored-by: renovate[bot] <29139614+renovate[bot]@users.noreply.github.com>
Co-authored-by: renovate[bot] <29139614+renovate[bot]@users.noreply.github.com>
Co-authored-by: renovate[bot] <29139614+renovate[bot]@users.noreply.github.com>
Co-authored-by: renovate[bot] <29139614+renovate[bot]@users.noreply.github.com>
Co-authored-by: renovate[bot] <29139614+renovate[bot]@users.noreply.github.com>
Co-authored-by: renovate[bot] <29139614+renovate[bot]@users.noreply.github.com>
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8 participants