Ta395_
MDF Size: 131328
dy2=0.98849066666667
r2(iHPMdCg) =
0.6471
dx2=0.014777690533333
y = 4.6256+-6.5790*iHPMdCg
| Mol
| iHPMdCg
| Y_pred
| Y
| Y_est
|
| t01
| 6.8888e-1
| 9.3458e-2
| -0.71
| 1.9065e-1
|
| t02
| 6.7692e-1
| 1.7214e-1
| -0.24
| 2.2773e-1
|
| t03
| 6.8825e-1
| 9.7603e-2
| 0.79
| 1.3288e-2
|
| t04
| 7.1764e-1
| -9.5753e-2
| 0.37
| -1.401e-1
|
| t05
| 7.6231e-1
| -3.8963e-1
| 0.4
| -4.4811e-1
|
| t06
| 8.1286e-1
| -7.222e-1
| -0.46
| -7.4207e-1
|
| t07
| 9.3301e-1
| -1.5126
| -1.93
| -1.4296
|
| t08
| 7.0291e-1
| 1.1551e-3
| -0.55
| 6.0136e-2
|
| t09
| 1.1461
| -2.9145
| -2.82
| -3.0954
|
| t10
| 6.6286e-1
| 2.6464e-1
| 0.92
| 1.6365e-1
|
| t11
| 7.3205e-1
| -1.9055e-1
| 0.09
| -2.147e-1
|
| t12
| 7.4405e-1
| -2.695e-1
| -1.5
| -1.7112e-1
|
| t13
| 8.3304e-1
| -8.5497e-1
| -1.05
| -8.3869e-1
|
| t14
| 8.3973e-1
| -8.9898e-1
| -0.26
| -9.549e-1
|
| t15
| 8.2764e-1
| -8.1944e-1
| -1.09
| -7.9754e-1 |
r2(Y,Y_PRED) = 0.6471
r2(Y,Y_EST) =
0.5725
r2 = 0.9766
id = 6
Indices = 2
Molecules = 15
r2(INDRLQt) =
0.12322848383492; dx2=0.033965306278462
r2(lHPmTMt) = 0.030396977726069;
dx2=0.58481696748622
y = -4.4881+8.3481*INDRLQt+1.9651*lHPmTMt
| Mol
| INDRLQt
| lHPmTMt
| Y_pred
| Y
| Y_est
|
| t01
| 1.0036e-1
| 1.5230
| -6.5743e-1
| -0.71
| -6.518e-1
|
| t02
| 9.7532e-2
| 1.6929
| -3.4717e-1
| -0.24
| -3.6008e-1
|
| t03
| 1.7757e-1
| 1.8224
| 5.7547e-1
| 0.79
| 5.2816e-1
|
| t04
| 3.9552e-2
| 2.3267
| 4.1428e-1
| 0.37
| 4.3008e-1
|
| t05
| 3.6702e-1
| 8.9296e-1
| 3.3057e-1
| 0.4
| 3.1965e-1
|
| t06
| 2.152e-1
| 1.0917
| -5.4628e-1
| -0.46
| -5.5233e-1
|
| t07
| 1.9234e-1
| 3.4779e-1
| -2.1989
| -1.93
| -2.3004
|
| t08
| 1.6609e-2
| 1.9683
| -4.8154e-1
| -0.55
| -4.6822e-1
|
| t09
| 2.3984e-2
| 8.545e-1
| -2.6087
| -2.82
| -2.4843
|
| t10
| 6.7342e-1
| -1.0394e-1
| 9.2942e-1
| 0.92
| 9.3914e-1
|
| t11
| 5.3514e-2
| 2.1696
| 2.2212e-1
| 0.09
| 2.5744e-1
|
| t12
| 1.2357e-1
| 9.6221e-1
| -1.5656
| -1.5
| -1.5763
|
| t13
| 3.7045e-1
| 3.3065e-1
| -7.4578e-1
| -1.05
| -6.9936e-1
|
| t14
| 4.7219e-1
| 2.1158e-1
| -1.3043e-1
| -0.26
| -9.9089e-2
|
| t15
| 3.4187e-1
| 2.0486e-1
| -1.2315
| -1.09
| -1.2595 |
r2(Y,Y_PRED) = 0.97657389144185
r2(Y,Y_EST) =
0.9614
| var
| id
| r2
| r2cv(loo)
| r2-r2cv(loo)
| CrossCor
|
| 2
| 6
| 0.97657389144185
| 0.96137071720028
| 0.015203174241564
| 0.62652
|
| 1
| 0
| 0.64708464604285
| 0.57254359134797
| 0.074541054694883
|