Statistical results of ten different combinations for CoMSIA models.
Combinations | q 2 | ONC | r 2 | SEE | F | r pred 2 | Field contribution (%) | ||||
---|---|---|---|---|---|---|---|---|---|---|---|
S | E | H | D | A | |||||||
CoMSIA | |||||||||||
S + E | 0.666 | 7 | 0.936 | 0.203 | 48.159 | 0.496 | 0.606 | 0.394 | — | — | — |
S + D | 0.663 | 5 | 0.936 | 0.194 | 73.688 | 0.409 | 0.971 | — | — | 0.029 | — |
S + E + H | 0.671 | 8 | 0.983 | 0.108 | 156.330 | 0.638 | 0.205 | 0.304 | 0.492 | — | — |
S + E + D | 0.668 | 9 | 0.994 | 0.092 | 87.329 | 0.576 | 0.832 | 0.150 | — | 0.018 | — |
S + E + A | 0.685 | 8 | 0.956 | 0.172 | 59.929 | 0.507 | 0.544 | 0.364 | — | — | 0.092 |
S + D + A | 0.667 | 4 | 0.936 | 0.192 | 94.518 | 0.531 | 0.834 | — | — | 0.046 | 0.120 |
S + E + H + D | 0.659 | 8 | 0.985 | 0.101 | 178.371 | 0.658 | 0.193 | 0.290 | 0.488 | 0.029 | — |
S + E + H + A | 0.646 | 8 | 0.985 | 0.102 | 175.012 | 0.643 | 0.202 | 0.296 | 0.460 | — | 0.042 |
S + E + D + A | 0.700 | 8 | 0.955 | 0.175 | 58.090 | 0.531 | 0.536 | 0.358 | — | 0.013 | 0.092 |
S + E + H + D + A | 0.669 | 8 | 0.985 | 0.100 | 181.447 | 0.869 | 0.192 | 0.284 | 0.456 | 0.029 | 0.039 |
Constraints | >0.5 | <10 | >0.9 | ≪1 | >100 | >0.5 | — | — | — | — | — |