Table 1 Model performance in experimental validation when using predictions with an average of 0.8 ± 0.06 confidence
From: Global reactivity models are impactful in industrial synthesis applications
ROC AUC | Accuracy (Label 1) | Recall (Label 1) | Precision (Label 1) | |
|---|---|---|---|---|
Experimental validation Mean Confidence 0.801 Standard Deviation 0.064 | 0.760 | 75.0% | 74.2% | 92.0% |