Table 3. Structure-Activity Relationships models: statistics. |
Characteristic (abbreviation) |
SAR model |
|
Eq(1) |
Eq(2) |
|
Correlation coefficient (r) |
0.9472 |
0.9868 |
Squared correlation coefficient (r2) |
0.8972 |
0.9737 |
Adjusted squared correlation coefficient (r2adj) |
0.8896 |
0.9695 |
Standard error of estimated (sest) |
0.2355 |
0.1238 |
Fisher parameter of estimated (Fest) |
118 |
231 |
Type I error associated with the Fisher parameter of estimated (pest) |
4.56·10-14 |
|
Leave-one-out cross-validation score (r2loo-cv) |
0.8745 |
0.9650 |
Fisher parameter of predicted (Fpred) |
93 |
172 |
Fisher probability of predicted (ppred) |
7.58·10-13 |
9.34 10-20 |
Standard error of predict (sloo) |
0.2613 |
0.1429 |
Difference
between squared correlation coefficient and leave-one-out cross- |
0.0227 |
0.0086 |
|