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update to qcschema py314#33

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loriab wants to merge 4 commits intoconda-forge:mainfrom
loriab:py314
Draft

update to qcschema py314#33
loriab wants to merge 4 commits intoconda-forge:mainfrom
loriab:py314

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@loriab
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@loriab loriab commented Mar 17, 2026

TODO before merge

  • update source to proper upstream simple-dftd3 release
  • remove the cbc.yaml and rerender after QCElemental v0.50 proper is released
  • LAB: remove the qcel pin in meta.yaml and add pytest

Checklist

  • Used a personal fork of the feedstock to propose changes
  • Bumped the build number (if the version is unchanged)
  • Reset the build number to 0 (if the version changed)
  • Re-rendered with the latest conda-smithy (Use the phrase @conda-forge-admin, please rerender in a comment in this PR for automated rerendering)
  • Ensured the license file is being packaged.

@loriab
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loriab commented Mar 17, 2026

@conda-forge-admin, please rerender

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Hi! This is the friendly automated conda-forge-linting service.

I just wanted to let you know that I linted all conda-recipes in your PR (recipe/meta.yaml) and found it was in an excellent condition.

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