Ligand | Preprocessing Strategy | Evaluation | ||
---|---|---|---|---|
Precision | Recall | F-score | ||
NADH | 1 | 0.1176 | 0.0385 | 0.0580 |
2 | 0.4375 | 0.1346 | 0.2059 | |
3 | 0.3636 | 0.0769 | 0.1270 | |
4 | 0.1875 | 0.0576 | 0.0882 | |
PIF | 1 | 0.2143 | 0.1731 | 0.1915 |
2 | 0.5294 | 0.3462 | 0.4186 | |
3 | 0.4667 | 0.1346 | 0.2090 | |
4 | 0.4571 | 0.3076 | 0.3678 | |
TCL | 1 | 0.1282 | 0.0962 | 0.1099 |
2 | 0.4412 | 0.2885 | 0.3488 | |
3 | 0.4286 | 0.1154 | 0.1818 | |
4 | 0.3928 | 0.2115 | 0.2750 | |
ETH | 1 | 0.3939 | 0.2500 | 0.3059 |
2 | 0.4375 | 0.2692 | 0.3333 | |
3 | 0.1250 | 0.0192 | 0.0333 | |
4 | 0.4516 | 0.2692 | 0.3373 |