Table 6.
Model | Class | Calibration Set | Validation Set | ||||||
---|---|---|---|---|---|---|---|---|---|
I | II | III | IV | I | II | III | IV | ||
RS_OPLS-DA | ACC (%) | 99.46 | 100.00 | 99.46 | 98.92 | 97.87 | 98.94 | 97.87 | 98.94 |
SE | 1.00 | 1.00 | 1.00 | 0.96 | 0.96 | 1.00 | 0.97 | 0.96 | |
SP | 0.99 | 1.00 | 0.99 | 1.00 | 0.99 | 0.99 | 0.98 | 1.00 | |
MCC | 0.99 | 1.00 | 0.99 | 0.97 | 0.95 | 0.96 | 0.95 | 0.97 | |
EFF | 1.00 | 1.00 | 1.00 | 0.98 | 0.97 | 0.99 | 0.98 | 0.98 | |
RL_OPLS-DA | ACC (%) | 99.46 | 100.00 | 100.00 | 99.46 | 95.74 | 97.87 | 97.87 | 97.87 |
SE | 1.00 | 1.00 | 1.00 | 0.98 | 0.88 | 1.00 | 0.97 | 0.96 | |
SP | 0.99 | 1.00 | 1.00 | 1.00 | 0.99 | 0.97 | 0.98 | 0.99 | |
MCC | 0.99 | 1.00 | 1.00 | 0.99 | 0.89 | 0.93 | 0.95 | 0.94 | |
EFF | 1.00 | 1.00 | 1.00 | 0.99 | 0.93 | 0.99 | 0.98 | 0.97 | |
SL_OPLS-DA | ACC (%) | 100.00 | 100.00 | 100.00 | 100.00 | 94.68 | 98.94 | 97.87 | 97.87 |
SE | 1.00 | 1.00 | 1.00 | 1.00 | 1.00 | 0.94 | 0.93 | 0.91 | |
SP | 1.00 | 1.00 | 1.00 | 1.00 | 0.93 | 1.00 | 1.00 | 1.00 | |
MCC | 1.00 | 1.00 | 1.00 | 1.00 | 0.88 | 0.96 | 0.95 | 0.94 | |
EFF | 1.00 | 1.00 | 1.00 | 1.00 | 0.96 | 0.97 | 0.96 | 0.96 | |
RSL_OPLS-DA | ACC (%) | 99.46 | 100.00 | 100.00 | 99.46 | 96.81 | 98.94 | 97.87 | 97.87 |
SE | 1.00 | 1.00 | 1.00 | 0.98 | 0.92 | 1.00 | 0.97 | 0.96 | |
SP | 0.99 | 1.00 | 1.00 | 1.00 | 0.99 | 0.99 | 0.98 | 0.99 | |
MCC | 0.99 | 1.00 | 1.00 | 0.99 | 0.92 | 0.96 | 0.95 | 0.94 | |
EFF | 1.00 | 1.00 | 1.00 | 0.99 | 0.95 | 0.99 | 0.98 | 0.97 |