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SMolInstruct

Benchmarks

Task NameDataset NameSOTA ResultTrend
Molecular GenerationSMolInstruct
RDK-FTS (%)70
14
Molecule CaptioningSMolInstruct (test)
BLEU-40.582
12
Molecule GenerationSMolInstruct (test)
EXACT51.9
11
RetrosynthesisSMolInstruct
Exact Match37.7
11
Forward SynthesisSMolInstruct
Exact Match62.9
11
Scientific ReasoningSmolInstruct
Score63.54
9
CaptioningSMolInstruct
METEOR44.6
7
Property PredictionSMolInstruct ClinTox
ClinTox Accuracy80.6
7
Property PredictionSMolInstruct BBBP
BBBP Accuracy0.802
7
Property PredictionSMolInstruct Lipo
Lipo RMSE1.22
7
Property PredictionSMolInstruct ESOL
ESOL RMSE1.73
7
Name ConversionSMolInstruct
I2S FTS Score90.7
7
RetrosynthesisSMolInstruct
RDK-FTS (%)63.7
7
Small MoleculeSmolInstruct
Score74.8
5
Showing 14 of 14 rows