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feat: implement ESOL and ClinTox evaluation datasets - #2

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SaraAngelucci merged 2 commits into
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feature/add-esol-clintox-datasets
May 15, 2026
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feat: implement ESOL and ClinTox evaluation datasets#2
SaraAngelucci merged 2 commits into
mainfrom
feature/add-esol-clintox-datasets

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@SaraAngelucci

@SaraAngelucci SaraAngelucci commented May 12, 2026

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Implemented the ESOL (regression) and ClinTox (classification) datasets. I've set up the loaders in contributed_datasets.py (to handle the missing label drops and 0/1 coercion for ClinTox). Tests are passing locally

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SaraAngelucci requested a review from jsture May 12, 2026 11:57
@SaraAngelucci SaraAngelucci added the enhancement New feature or request label May 12, 2026

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Unstage irrelevant formatting changed files

@@ -36,12 +36,8 @@ def file_sha256(path: Path) -> str:

def main() -> None:

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There's no need to commit files with formatting changes that you aren't make active changes to. Just unstage them and keep the files you're actively contributing.

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done, but then the CI / Lint test is still failing because the CI is currently flagging other existing files in the repo

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SaraAngelucci force-pushed the feature/add-esol-clintox-datasets branch from 644a47e to 77bb07b Compare May 13, 2026 21:10
@SaraAngelucci
SaraAngelucci force-pushed the feature/add-esol-clintox-datasets branch from 77bb07b to 193a9bf Compare May 13, 2026 21:12
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SaraAngelucci requested a review from jsture May 13, 2026 21:24

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LGTM! As long as tests pass. I'll fix the Lint some other time.

Merge!

@SaraAngelucci
SaraAngelucci merged commit 9d5ec34 into main May 15, 2026
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SaraAngelucci deleted the feature/add-esol-clintox-datasets branch May 15, 2026 21:21
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2 participants