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PMO

Benchmarks

Task NameDataset NameSOTA ResultTrend
Goal-directed molecular optimizationPMO
Albuterol Similarity0.977
16
RediscoveryPMO-1K
Cele. Score0.867
12
Multi property optimizationPMO-1K
Amlo. Score85.6
12
Molecular OptimizationPMO-300
Albuterol Similarity89
7
Molecular OptimizationPMO benchmark
AUC Top-113.997
4
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