Table 3. RuleFit Five Most Important Rules per Morphologya.
| sphere |
worm |
vesicle |
||||||
|---|---|---|---|---|---|---|---|---|
| condition | coef. | imp.(num) | condition | coef. | imp.(num) | condition | coef. | imp.(num) |
| mw_tot_cre > 16161.4751 conc > 16.1 mw_tot_cna ≤ 12760.5298 | –2.9319 | 1.4166 (207) | 8503.8901 < mw_tot_cna ≤ 12760.5298 vol_ratio > 0.2135 | 1.8748 | 0.85406 (155) | temp > 65.0 vol_ratio ≤ 0.2599 sphere = 0 | 1.8179 | 0.8247 (162) |
| dp_cna ≤ 65.0 vol_ratio ≤ 0.3104 clogp_cre ≤ 1.37 | –1.7521 | 0.8759 (298) | apol_cna ≤ 42.472 mass_ratio ≤ 0.248 sphere = 0 | –1.894 | 0.8235 (152) | mw_tot_cna ≤ 56.8499 mass_ratio ≤ 0.37610 ph ≤ 4.25 | 2.3528 | 0.7713 (63) |
| mass_ratio ≤ 0.4342 mw_cre ≤ 145.3096 charge = 0 | –1.7228 | 0.8285 (209) | conc > 11.25 mass_ratio ≤ 0.4286 clogp_cre ≤ 1.4 | 1.3809 | 0.6899 (299) | mw_tot_cna > 10236.2549 mass_ratio ≤ 0.2292 conc > 11.25 | 1.9049 | 0.6061 (58) |
| mw_tot_cre > 143.8346 charge = 0 vol_ratio ≤ 0.6135 | 1.3356 | 0.6564 (243) | mv_tot_cre > 120.6472 psa_cre ≤ 46.7805 mv_tot_cre > 171.5035 | –1.3361 | 0.6036 (424) | conc ≤ 18.75 vol_ratio ≤ 0.3794 mw_tot_cna ≤ 5806.375 | 2.0187 | 0.5888 (48) |
| mw_tot_cna > 9204.0249 charge = 1 | –1.3740 | 0.6356 (179) | ph > 2.625 vol_ratio > 0.2153 | –1.2106 | 0.5991 (265) | mass_ratio ≤ 0.2292 mw_tot_cna > 4260.0101 clogp_cre ≤ 1.18 | 1.1943 | 0.5851 (239) |
a
For each rule condition, coefficient, and importance are given. The number in parentheses below the importance denotes the number of data points that satisfy the condition.