Table 2.
Spectra | Model | Number of LV | Calibration | Cross-Validation | Prediction | ΔE | ||||
---|---|---|---|---|---|---|---|---|---|---|
r C | RMSEC | r CV | RMSECV | r P | RMSEP | RPD | ||||
RAW | RAW-PLS 1 | 13 | 0.957 | 13.077 | 0.930 | 15.703 | 0.928 | 16.343 | 3.537 | 3.266 |
SGS | SGS-PLS 2 | 14 | 0.971 | 11.314 | 0.934 | 15.235 | 0.926 | 16.319 | 3.542 | 5.005 |
NC | NC-PLS 3 | 14 | 0.974 | 10.674 | 0.953 | 13.174 | 0.956 | 13.798 | 4.189 | 3.124 |
MSC | MSC-PLS 4 | 14 | 0.974 | 10.671 | 0.932 | 15.499 | 0.918 | 16.428 | 3.518 | 5.757 |
1st Der | 1st Der-PLS 5 | 8 | 0.944 | 13.170 | 0.889 | 17.907 | 0.877 | 18.114 | 3.191 | 4.944 |
2nd Der | 2nd Der-PLS 6 | 5 | 0.915 | 18.949 | 0.892 | 21.566 | 0.881 | 22.335 | 2.588 | 3.386 |
BC | BC-PLS 7 | 12 | 0.950 | 14.237 | 0.906 | 20.135 | 0.913 | 20.253 | 2.854 | 6.016 |
SNV | SNV-PLS 8 | 11 | 0.947 | 14.611 | 0.894 | 21.421 | 0.887 | 23.916 | 2.417 | 9.305 |
MCT | MCT-PLS 9 | 13 | 0.957 | 13.077 | 0.910 | 20.703 | 0.893 | 21.744 | 2.658 | 8.667 |
1 PLS model built with raw spectra; 2 PLS model built with SGS spectra; 3 PLS model built with NC spectra; 4 PLS model built with MSC spectra; 5 PLS model built with 1st Der spectra; 6 PLS model built with 2nd Der spectra; 7 PLS model built with BC spectra; 8 PLS model built with SNV spectra; 9 PLS model built with MCT spectra.