Table 4 External validation
S/no | Activity | ATSc5 | ATSm1 | nBondsM | MDEC-13 | ndsN | Ypred | (Ypred − Yobs) |
|---|---|---|---|---|---|---|---|---|
1 | 0.748188 | − 0.09095 | 30.34183 | 10 | 0 | 4 | 1.482858 | 0.73467 |
4 | 0.919078 | − 0.10029 | 39.05478 | 10 | 0 | 4 | 0.96808 | 0.049002 |
7 | 0.342423 | − 0.27593 | 40.62243 | 10 | 0 | 6 | 0.624095 | 0.281672 |
13 | 0.94939 | − 0.08001 | 35.25075 | 10 | 0 | 6 | 1.653117 | 0.703727 |
16 | 2.474508 | − 0.06526 | 21.62888 | 10 | 0 | 6 | 2.458433 | − 0.01607 |
19 | 2.232488 | − 0.18624 | 24.40335 | 10 | 1.23799 | 5 | 1.811596 | − 0.42089 |
21 | 0.755875 | − 0.12052 | 39.64029 | 10 | 1.857354 | 4 | 1.097961 | 0.342086 |
25 | 1.912753 | − 0.00494 | 33.70181 | 10 | 2.876191 | 5 | 2.187817 | 0.275064 |
28 | 2.115943 | − 0.0674 | 39.43347 | 9 | 1.782569 | 5 | 1.189993 | − 0.92595 |
30 | 0.973128 | − 0.08618 | 31.92734 | 9 | 1.668818 | 5 | 1.518469 | 0.545341 |
34 | 2.635383 | − 0.05827 | 22.21439 | 10 | 1.54067 | 4 | 2.250008 | − 0.38538 |