Model/no descriptors | MAE (D) | R2/RMSE (D) |
---|---|---|
Training set | ||
C/75a | 0.515 | 0.826/0.769 |
C/100a | 0.517 | 0.826/0.771 |
C/125a | 0.518 | 0.826/0.7709 |
C/32b | 0.521 | 0.824/0.773 |
C/39c | 0.523 | 0.824/0.775 |
C/296d | 0.529 | 0.821/0.782 |
F/75a | 0.482 | 0.844/0.731 |
F/100a | 0.482 | 0.844/0.731 |
F/125a | 0.483 | 0.844/0.732 |
F/34b | 0.501 | 0.838/0.745 |
F/41c | 0.499 | 0.838/0.743 |
F/297d | 0.503 | 0.832/0.755 |
Test set | ||
C/75a | 0.502 | 0.847/0.744 |
C/100a | 0.506 | 0.846/0.748 |
C/125a | 0.505 | 0.845/0.748 |
C/32b | 0.509 | 0.845/0.747 |
C/39c | 0.512 | 0.844/0.749 |
C/296d | 0.519 | 0.843/0.758 |
F/75a | 0.468 | 0.864/0.704 |
F/100a | 0.466 | 0.865/0.702 |
F/125a | 0.466 | 0.867/0.699 |
F/34b | 0.481 | 0.860/0.713 |
F/41c | 0.479 | 0.860/0.710 |
F/297d | 0.485 | 0.852/0.725 |