Table 2. Summary of parameters for assessment of the quality of OPLS-DA models.
Extracts | R2Xcum a | R2Ycum a | Q2Ycum b | P c | |
GC-TOF-MS | MW d | 0.417 | 0.993 | 0.843 | 0.001 |
DM e | 0.379 | 0.984 | 0.834 | <0.001 | |
UPLC-Q-TOF-MS | MW | 0.606 | 1.000 | 0.737 | 0.090 |
DM | 0.466 | 1.000 | 0.734 | 0.022 | |
Nanomate LTQ-MS | Lipid f | 0.521 | 0.812 | 0.587 | 0.015 |
R2Xcum and R2Ycum are the cumulative modeled variation in X and Y matrix, respectively.
Q2Ycum is the cumulative predicted variation in Y matrix.
P is p value obtained from cross validation ANOVA of OPLS-DA.
MW, methanol/water (1∶1, v/v).
DM, dichloromethane/methanol (3∶1, v/v).
The lipid extract for nanomate LTQ-MS analysis was prepared as mentioned in M&M section.