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Papers Benchmarks Datasets Tasks

DILI dataset and benchmarks · SOTA2 Research

Research Datasets

DILI

Benchmarks

Task NameDataset NameSOTA MethodSort

Task NameDataset NameSOTA ResultTrendResults

Molecular property prediction

DILI 475 drugs

95.08AUC

12

Property-Specific Molecule Generation

DILI

2.38Synthetic Accessibility (SA)

9

Molecular optimization

DILI TDC (test)

18.451Improvement (%)

8

Molecular Property Classification

DILI

1.1Delta ID-Churn

5

Distributional disagreement (sym-KL)

DILI (id-test)

-0.07Delta Symmetric KL Divergence (delta sym-KL)

5

DILI classification

DILI

0.847Accuracy

4

Top-K ranking stability

DILI id (test)

0.69Jaccard Similarity

3

Popular tasks

Molecular property prediction Molecular Property Classification Molecular Optimization DILI classification Property-Specific Molecule Generation

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