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Blood-brain barrier penetration from structure
Classify whether a compound crosses the blood-brain barrier, scored by AUROC on TDC’s scaffold split of 1,975 drugs.
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基线保持在 AUROC 0.924。
Classify whether a compound crosses the blood-brain barrier, scored by AUROC on TDC’s scaffold split of 1,975 drugs.
基线保持在 AUROC 0.924。