Research Article
A Variable Selection Method Based on Fast Nondominated Sorting Genetic Algorithm for Qualitative Discrimination of Near Infrared Spectroscopy
Table 2
Classification results of PLS-DA model based on different variables selection methods.
| Model | Number of variables | Class | Calibration set | Prediction set | Sen | Spe | CDR (%) | RDR (%) | Sen | Spe | CDR (%) | RDR (%) |
| PLS-DA | 1036 | B | 0.879 | 0.917 | 79.57 | 96.77 | 0.800 | 0.905 | 77.42 | 96.77 | C | 0.667 | 0.905 | 0.583 | 0.947 | X | 0.833 | 0.873 | 1.000 | 0.818 |
| NSGA-II-PLS-DA | 160 | B | 0.970 | 0.933 | 87.10 | 100 | 0.900 | 0.857 | 80.65 | 100 | C | 0.633 | 0.984 | 0.583 | 0.947 | X | 1.000 | 0.889 | 1.000 | 0.909 |
| CARS-PLS-DA | 91 | B | 0.970 | 0.917 | 84.95 | 98.92 | 1.000 | 0.857 | 80.65 | 100 | C | 0.633 | 0.968 | 0.583 | 0.947 | X | 0.933 | 0.889 | 0.889 | 0.909 |
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Note “Sen,” “Spe,” “CDR,” and “RDR” denote sensitivity, specificity, correct discriminant rate, and reasonable discriminant rate, respectively.
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