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Endocrine Disruption Explainer v1.0.0

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@andresilvapimentel andresilvapimentel released this 11 Apr 21:21
· 4 commits to main since this release
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Endocrine Disruption Explainer is a code to generate structural alerts of endocrine disruption of chemcial compounds using Local Interpretable Model-Agnostic Explanations (LIME) of machine learning models from TOX-21, EDC, and EDKB-FDA datasets.