summaryrefslogtreecommitdiff
path: root/vignettes/KinGUI/A_FOMC_report_detailed.txt
blob: 2b14a228cc72ae6b4c6d17fab6dfd09718666963 (plain) (blame)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
Project:            
Testsystem:         
Comment:            NA

KinGUI Version: 1.1

Input Data:         C:\Documents and Settings\jranke\My Documents\R\mkin.BerliOS\R_packages\kinfit\trunk\inst\doc\KinGUI\A_KinGUI.txt

# =================================
# Results of the kinetic evaluation
# =================================

# ---------------------------------
# Initial values
# ---------------------------------
                    Initial Value    Lower Bound      Upper Bound      
        Parent_M(0):   100.0000           0.0000              Inf      
       Parent_alpha:     1.0000           0.0000              Inf      
        Parent_beta:    10.0000           0.0000              Inf      
          Sink_M(0):     0.0000           0.0000              Inf      

# ---------------------------------
# Chi2 error estimation
# ---------------------------------
                          Parent      Sink       All
  Number of data sets:         8         0         8
 Number of parameters:         3         0         3
   Degrees of Freedom:         5         0         5

                          Parent      Sink       All

                 RMSE:    6.9610       NaN    6.9610
            Chi2Sigma:    4.6781       NaN    4.6781
             Chi2Err%:    9.3462       NaN    9.3462

# ---------------------------------
# Parameter estimation
# ---------------------------------

   Degrees of Freedom:         5
    Parameter   Estimate   Lower CI   Upper CI     St.Dev   Prob > t
 Parent_alpha    26.0717  -467.3094   519.4528   191.9336     0.4486
  Parent_beta   682.1168<-1000.0000 >1000.0000 >1000.0000     0.4500
   Parent_FFS     1.0000
  Parent_M(0)   109.4699    95.0742   123.8656     5.6002
    Sink_M(0)     0.0000

# ---------------------------------
# DT50 and DT90 values
# ---------------------------------
                       Parent         Sink
           DT50:      18.3781          NaN
           DT90:      62.9832          NaN
  Kinetic model:         fomc         sink

# ---------------------------------
# Additional Statistics
# ---------------------------------
# Correlation and R-square of predicted vs. measured data
               Parent       Sink       All
       EF:     0.9831        NaN     0.9831
 R-square:     0.9845        NaN     0.9845

# Correlation matrix of parameters
              Parent_alpha  Parent_beta     Parent_M
 Parent_alpha       1.0000       0.9998      -0.4272
  Parent_beta       0.9998       1.0000      -0.4364
     Parent_M      -0.4272      -0.4364       1.0000

# ---------------------------------
# Measured vs. predicted values
# ---------------------------------
   Time            Compartment Parent              Compartment Sink
         measured predicted  residual  measured predicted  residual
    0.0  101.2400  109.4699   -8.2299       NaN    0.0000       NaN
    3.0   99.2700   97.6350    1.6350       NaN   11.8349       NaN
    7.0   90.1100   83.8862    6.2238       NaN   25.5837       NaN
   14.0   72.1900   64.4547    7.7353       NaN   45.0152       NaN
   30.0   29.7100   35.6410   -5.9310       NaN   73.8288       NaN
   62.0    5.9800   11.3304   -5.3504       NaN   98.1395       NaN
   90.0    1.5400    4.3252   -2.7852       NaN  105.1447       NaN
  118.0    0.3900    1.7087   -1.3187       NaN  107.7612       NaN

Contact - Imprint