TABLE 1.
A | B | C | D | |
---|---|---|---|---|
CoMFA | ||||
Total Compounds | 36 | 29 | 16 | 16 |
n | 7 | 4 | 5 | 2 |
q2cv | 0.65 | 0.55 | 0.57 | 0.79 |
SEE | 0.29 | 0.32 | 0.17 | 0.12 |
r2 | 0.93 | 0.89 | 0.98 | 0.99 |
F statistic | 55.9 | 50.5 | 74.4 | 311 |
CoMSIA | ||||
Total compounds | 36 | 29 | 16 | 16 |
n | 5 | 3 | 3 | 2 |
q2cv | 0.50 | 0.55 | 0.65 | 0.61 |
SEE | 0.32 | 0.34 | 0.26 | 0.11 |
r2 | 0.91 | 0.86 | 0.93 | 0.99 |
F statistic | 62.5 | 51.5 | 47.4 | 358 |