Journal of Chemical Information and Modeling· 2026Q1
Measuring AI Progress in Drug Discovery: A Reproducible Leaderboard for the Tox21 Challenge
- 1citations
- Q1SCImago
- 2026year
Short summary
A new reproducible leaderboard using the original Tox21 Challenge data set reveals that top-performing AI models for toxicity prediction have not significantly advanced since 2015-2017, questioning the extent of progress in the field.
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Computational Theory and MathematicsComputer Science