Table 2.
Model | All | Categories |
|||||
---|---|---|---|---|---|---|---|
Thermal | Thermod. & physical | Electronic | Optical & dielectric | Mech. | Solubility & permeability | ||
GP-ST | 0.93 | 0.92 | 0.86 | 0.88 | 0.98 | 1.00 | 0.93 |
NN-ST | 0.89 | 0.95 | 0.76 | 0.91 | 0.91 | 0.95 | 0.94 |
NN-MT1 | 0.89 | 0.98 | 0.83 | 0.97 | 0.83 | 0.94 | 0.92 |
NN-MT2-all | 0.79 | 0.97 | 0.82 | 0.96 | 0.69 | 0.89 | 0.70 |
NN-MT2-sub | 0.65 | 0.94 | 0.87 | 0.79 | 0.47 | 0.82 | 0.46 |
The root mean squared error averages were normalized for each property so that the maximal value is 1.