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. 2023 Feb 10;28(4):1696. doi: 10.3390/molecules28041696
MLR_cfs Multiple Linear regression on correlation based features selected
SVM_cfs Support Vector Machine on correlation based features selected
GBM Gradient Boosting Model
RF Random Forest: tR- Retention Time
CFS Correlation based feature Selection
RFE Recursive Feature Elimination
AD Applicability Domain
RMSE Root mean Squared Error
CV Cross Validation
R2 Coefficient of Correlation
LC Liquid Chromatography