Table 1 Optimization set prediction statistics for log10[S∞]
From: QSPR modeling of selectivity at infinite dilution of ionic liquids
Split (CV. %) | MAE | MAE per IL | Range | Covariance | Decision | |
|---|---|---|---|---|---|---|
log10[S∞] | 20 | 0.119 | 0.170 | 0.24 | 5.23E−06 | 0.0126317 |
50 | 0.128 | 0.173 | 0.01 | 0.00014608 | 0.0134264 | |
80 | 0.132 | 0.177 | 0.66 | 3.83E−06 | 0.0155686 |