Table 2. Results of the Bayesian models for the test set I.
Model | No of molecules in training set I | TP/FN FP/TN | SE | SP | AC |
---|---|---|---|---|---|
Doddareddy's best model (SVM-ECFP_6) | 255 | 90/18 12/135 | 0.83 | 0.92 | 0.88 |
Model 1: Simple descriptors | 255 | 98/10 37/110 | 0.91 | 0.75 | 0.82 |
Model 2: Descriptors+ECFP_14 | 255 | 97/11 11/136 | 0.90 | 0.92 | 0.91 |