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. 2012 Apr 26;13(2):611–622. doi: 10.1208/s12249-012-9782-7

Table III.

Principal Component Regression of MSC, SNV, and Savitzky–Golay Second Derivative-Transformed NIR Spectra for Calibration and Prediction of Letrozole and PLGA

MSC SNV Savitzky–Golay
Calibration Prediction Calibration Prediction Calibration Prediction
Samples 36 36 36 36 36 36
Slope 0.957412 0.82900 0.957483 0.828827 0.977374 0.964158
Offset 0.448953 1.93057 0.448200 1.932293 0.238517 0.777366
Correlation 0.978474 0.96485 0.978511 0.964810 0.988622 0.990186
RMSE 1.165071 1.24002 1.164094 1.240839 0.849203 0.740259
SEC/SEP 1.181598 1.21242 1.180607 1.213250 0.861249 0.602415
Bias 1.325e-07 0.329 9.272e-08 0.329539 −1.457e-07 0.441769

Second derivative transformation showed lower RMSE, SEC, SEP, and a higher correlation coefficient than MSC and SNV-treated spectra