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Table 3 Results of the PLSR models constructed using the three techniques

From: On-spot quantification of modafinil in generic medicines purchased from the Internet using handheld Fourier transform-infrared, near-infrared and Raman spectroscopy

Modelnumber

F

C:V ratio

r2calib

RMSEC (% m/m)

r2 valid

RMSEP (% m/m)

RSEP (%)

FTIRM1

3

25:11

0.98

0.52

0.97

0.78

1.33

FTIRM2

1

12:60

0.51

11.24

0.49

11.61

29.9

FTIRM3

1

14:70

0.75

6.57

0.93

4.63

16.5

FTIRM4

4

60:20

0.84

6.29

0.80

7.03

19.8

NIRM1

1

25:11

0.72

8.45

0.70

8.82

23.3

NIRM2

1

12:60

0.84

5.26

0.84

5.25

15.2

NIRM3

3

14:70

0.99

1.15

0.99

1.21

 3.45

NIRM4

1

60:20

0.77

1.77

0.69

2.05

3.51

NIRM5

1

48:16

0.69

1.91

0.76

1.71

2.85

RamanM1

1

25:11

0.70

8.49

0.80

6.74

19.0

RamanM2

1

12:60

0.84

5.52

0.83

6.57

17.8

RamanM3

1

14:70

0.76

7.62

0.83

9.16

23.9

RamanM4

4

60:20

0.98

0.54

0.95

0.82

1.40

RamanM5

4

48:16

0.94

0.96

0.93

0.91

12.1

  1. FTIRM1, NIRM1 and RamanM1 modafinil lactose dilution; FTIRM2, NIRM2 and RamanM2 modafinil excipients dilution; FTIRM3, NIRM3 and RamanM3 modafinil excipients sequential addition; FTIRM4, NIRM4 and RamanM4 modafinil powdered tablets model; NIRM5 and RamanM5 modafinil intact tablet model; C:V calibration:validation ratio; F number of factors, r2 correlation coefficient, RMSE:root mean square error