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Statistical validation results of probable CoMFA models.
| Descriptors | Q2 | R2 | SEE | N |
|---|---|---|---|---|
| Steric (S) | 0.412 | 0.837 | 0.0773 | 3 |
| Electrostatic (E) | 0.409 | 0.918 | 0.0575 | 3 |
| S + E | 0.539 | 0.903 | 0.0615 | 5 |
Q2: Leave one out cross-validated correlation coefficient.
R2: Non-cross validated correlation coefficient.
SEE: Standard error of estimation.
N: number of optimum components.
