| Descriptors |
| No. |
Y |
Threonine |
Lipid |
Lactate |
Alanine |
Lipid |
ANN |
MLR |
| Training set |
| 1 |
75.80 |
0.03 |
0.04 |
0.01 |
0.01 |
0.01 |
74.49 |
73.80 |
| 3 |
88.70 |
0.04 |
0.06 |
0.01 |
0.01 |
0.01 |
87.55 |
87.06 |
| 5 |
70.40 |
0.03 |
0.04 |
0.01 |
0.01 |
0.01 |
70.30 |
72.34 |
| 7 |
84.50 |
0.03 |
0.06 |
0.01 |
0.01 |
0.01 |
83.44 |
84.41 |
| 9 |
86.40 |
0.04 |
0.06 |
0.01 |
0.01 |
0.01 |
85.82 |
89.04 |
| 11 |
69.90 |
0.03 |
0.04 |
0.01 |
0.01 |
0.01 |
70.80 |
70.86 |
| 13 |
100.30 |
0.05 |
0.06 |
0.02 |
0.01 |
0.02 |
99.5 |
103.13 |
| 15 |
82.50 |
0.04 |
0.06 |
0.01 |
0.01 |
0.01 |
83.59 |
84.18 |
| 17 |
80.00 |
0.03 |
0.05 |
0.01 |
0.01 |
0.01 |
81.27 |
79.49 |
| 19 |
85.00 |
0.04 |
0.05 |
0.02 |
0.01 |
0.01 |
85.55 |
85.49 |
| 21 |
75.80 |
0.03 |
0.05 |
0.01 |
0.01 |
0.01 |
76.38 |
75.01 |
| 23 |
88.70 |
0.03 |
0.05 |
0.01 |
0.01 |
0.02 |
89.33 |
83.91 |
| 25 |
70.40 |
0.04 |
0.03 |
0.01 |
0.01 |
0.01 |
69.8 |
73.07 |
| 27 |
84.50 |
0.04 |
0.05 |
0.01 |
0.01 |
0.01 |
84.38 |
83.50 |
| 29 |
86.40 |
0.04 |
0.05 |
0.01 |
0.02 |
0.01 |
85.22 |
89.03 |
| 31 |
70.10 |
0.03 |
0.03 |
0.01 |
0.01 |
0.01 |
72.20 |
70.42 |
| 33 |
71.00 |
0.03 |
0.04 |
0.01 |
0.01 |
0.01 |
68.58 |
69.43 |
| 35 |
74.00 |
0.03 |
0.06 |
0.01 |
0.01 |
0.00 |
74.18 |
72.30 |
| 37 |
73.40 |
0.03 |
0.04 |
0.01 |
0.01 |
0.01 |
75.76 |
70.57 |
| 39 |
81.00 |
0.04 |
0.05 |
0.01 |
0.01 |
0.01 |
81.40 |
82.69 |
| 41 |
77.00 |
0.04 |
0.05 |
0.02 |
0.01 |
0.00 |
76.15 |
78.01 |
| 43 |
45.70 |
0.02 |
0.03 |
0.01 |
0.01 |
0.00 |
44.38 |
47.39 |
| 45 |
47.20 |
0.03 |
0.03 |
0.00 |
0.00 |
0.00 |
46.90 |
47.60 |
| 47 |
49.10 |
0.03 |
0.02 |
0.01 |
0.01 |
0.00 |
49.30 |
47.75 |
| 49 |
45.50 |
0.02 |
0.02 |
0.01 |
0.01 |
0.01 |
44.01 |
50.83 |
| 51 |
45.50 |
0.02 |
0.03 |
0.01 |
0.00 |
0.01 |
46.87 |
45.00 |
| 53 |
42.60 |
0.00 |
0.05 |
0.01 |
0.01 |
0.01 |
43.67 |
44.85 |
| 55 |
52.80 |
0.02 |
0.04 |
0.01 |
0.00 |
0.00 |
51.90 |
54.20 |
| 57 |
41.50 |
0.02 |
0.02 |
0.00 |
0.01 |
0.00 |
43.29 |
39.32 |
| 2 |
80.60 |
0.03 |
0.05 |
0.03 |
0.00 |
0.00 |
81.64 |
83.21 |
| 6 |
85.60 |
0.04 |
0.06 |
0.02 |
0.01 |
0.01 |
86.49 |
87.44 |
| 12 |
70.20 |
0.03 |
0.04 |
0.01 |
0.01 |
0.01 |
69.52 |
71.59 |
| 14 |
87.50 |
0.03 |
0.07 |
0.02 |
0.01 |
0.01 |
86.19 |
85.73 |
| 20 |
84.00 |
0.03 |
0.06 |
0.02 |
0.01 |
0.01 |
85.11 |
83.87 |
| 24 |
89.10 |
0.04 |
0.06 |
0.01 |
0.01 |
0.01 |
89.98 |
84.77 |
| Test set |
| 28 |
79.30 |
0.04 |
0.06 |
0.01 |
0.01 |
0.01 |
78.24 |
80.03 |
| 32 |
72.00 |
0.03 |
0.05 |
0.01 |
0.01 |
0.01 |
74.80 |
74.88 |
| 36 |
73.50 |
0.03 |
0.05 |
0.01 |
0.01 |
0.00 |
72.94 |
71.12 |
| 40 |
78.00 |
0.04 |
0.04 |
0.02 |
0.01 |
0.01 |
79.20 |
70.65 |
| 46 |
52.80 |
0.03 |
0.03 |
0.00 |
0.01 |
0.00 |
49.13 |
52.55 |
| 50 |
50.50 |
0.02 |
0.03 |
0.01 |
0.00 |
0.01 |
53.70 |
53.07 |
| 54 |
51.00 |
0.02 |
0.04 |
0.01 |
0.00 |
0.01 |
51.35 |
53.28 |
| 58 |
46.50 |
0.02 |
0.03 |
0.01 |
0.00 |
0.01 |
47.09 |
49.00 |
| 4 |
89.10 |
0.04 |
0.05 |
0.02 |
0.01 |
0.01 |
89.80 |
86.04 |
| 8 |
79.30 |
0.03 |
0.05 |
0.02 |
0.01 |
0.01 |
78.04 |
76.68 |
| 10 |
78.10 |
0.03 |
0.05 |
0.01 |
0.01 |
0.01 |
78.60 |
75.30 |
| 14 |
92.50 |
0.04 |
0.06 |
0.02 |
0.01 |
0.01 |
90.72 |
87.33 |
| 18 |
77.50 |
0.04 |
0.04 |
0.01 |
0.01 |
0.01 |
77.37 |
75.48 |
| Validation set |
| 22 |
80.60 |
0.03 |
0.05 |
0.01 |
0.02 |
0.00 |
84.3 |
77.29 |
| 26 |
85.60 |
0.04 |
0.05 |
0.02 |
0.01 |
0.02 |
84.76 |
86.13 |
| 30 |
78.40 |
0.03 |
0.05 |
0.01 |
0.01 |
0.01 |
71.62 |
76.34 |
| 32 |
75.00 |
0.03 |
0.05 |
0.01 |
0.01 |
0.00 |
73.26 |
72.15 |
| 38 |
80.00 |
0.04 |
0.04 |
0.02 |
0.01 |
0.01 |
79.10 |
74.84 |
| 42 |
75.00 |
0.04 |
0.05 |
0.01 |
0.01 |
0.01 |
75.85 |
79.10 |
| 44 |
42.60 |
0.01 |
0.03 |
0.01 |
0.01 |
0.00 |
41.30 |
40.32 |
| 48 |
46.50 |
0.01 |
0.04 |
0.01 |
0.00 |
0.01 |
42.49 |
48.58 |
| 52 |
49.10 |
0.03 |
0.03 |
0.01 |
0.00 |
0.00 |
49.42 |
58.14 |
| 56 |
52.80 |
0.03 |
0.03 |
0.01 |
0.01 |
0.01 |
47.51 |
56.83 |
|
