Table 2. Statistics for Pharmacophore AANRR.
factor | SD | R2 | R2 CV | R2 scramble | stability | F | P | RMSE | Q2 | Pearson-r |
---|---|---|---|---|---|---|---|---|---|---|
1 | 0.6432 | 0.6217 | 0.5576 | 0.2071 | 0.99 | 133.1 | 8.91 × 10–19 | 0.66 | 0.6147 | 0.8008 |
2 | 0.5147 | 0.7608 | 0.6507 | 0.317 | 0.969 | 127.2 | 1.41 × 10–25 | 0.67 | 0.6133 | 0.799 |
3 | 0.4389 | 0.8282 | 0.6886 | 0.4326 | 0.937 | 126.9 | 3.97 × 10–30 | 0.66 | 0.6226 | 0.8005 |
4 | 0.4135 | 0.8494 | 0.6953 | 0.5202 | 0.924 | 110 | 2.92 × 10–31 | 0.7 | 0.5734 | 0.7741 |
5 | 0.3702 | 0.8809 | 0.6901 | 0.5946 | 0.863 | 113.8 | 4.21 × 10–34 | 0.71 | 0.5641 | 0.7739 |
6 | 0.3429 | 0.8991 | 0.6781 | 0.6536 | 0.853 | 112.9 | 8.94 × 10–36 | 0.73 | 0.531 | 0.7528 |
7 | 0.3107 | 0.9183 | 0.6533 | 0.715 | 0.831 | 120.4 | 3.88 × 10–38 | 0.76 | 0.501 | 0.7455 |
8 | 0.288 | 0.9307 | 0.6423 | 0.7583 | 0.808 | 124.2 | 1.02 × 10–39 | 0.78 | 0.4637 | 0.7214 |
9 | 0.2613 | 0.9437 | 0.6347 | 0.7941 | 0.765 | 136 | 6.26 × 10–42 | 0.83 | 0.397 | 0.6972 |