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Boomer Batch File
4 wls,bayes,sim,irwls,sim+error,grid Note 1
1 Screen, diskfile
f2121kelV
1 Parameter type
Dose
100.0 Parameter value
0 Fixed,adjust,depend1,depend2
1 To
0 F-dependence ?
0 happy or not
2 Parameter type
kel
0.2000 Parameter value
1 Fixed,adjust,depend1,depend2 Note 2
0.19990
0.20001
2
0.01
0 To
1 From
0 happy or not
18 Parameter type
V
15.00 Parameter value
1 Fixed,adjust,depend1,depend2 Note 2
14.999
15.001
2
0.01
1 To
Cp
1 From
0 happy or not
-1 Parameter type
2 Integration method
0.000 Relative error
0.000 Absolute error
Simulation kel varying
1 Data from disk or keyboard
0.000 X value
0.000 Y value
1.000 X value
0.000 Y value
2.000 X value
0.000 Y value
3.000 X value
0.000 Y value
4.000 X value
0.000 Y value
5.000 X value
0.000 Y value
6.000 X value
0.000 Y value
7.000 X value
0.000 Y value
8.000 X value
0.000 Y value
9.000 X value
0.000 Y value
10.00 X value
0.000 Y value
-1.000 X value
0 Accept, correct, delete, insert, of
0 Continue or save data
0 Error type for line
0 Weight type Note 3
0 AUC line number
10 Continue,save,plot,supplemental,sen Note 4
-1 wls,bayes,sim,irwls,sim+error,grid
Note 1 Select 'Simulation with random error or sensitivity analysis'
Note 2 Set parameters to be adjustable. Enter 'known' parameter values and set close upper and lower limits
Note 3 Select equal weight. Other weighting is possible but interpretation is curious
Note 4
Select option 10 for graphs and sensitivity
The output of this run is shown in Figure 21.4.2.
** FINAL OUTPUT FROM Boomer (v3.4.7) ** 16 February 2021 --- 11:36:35 am Title: Simulation kel varying Input: From f2121kelv.BAT Output: To f2121kelV.OUT Data for Cp came from keyboard (or ?.BAT) Fitting algorithm: Simulation with Error Note 1 Weighting for Cp by Equal weight Numerical integration method: 2) Fehlberg RKF45 with 1 de(s) With relative error 0.1000E-03 With absolute error 0.1000E-03 This simulation took 0.3800 seconds # Name Value Low Original High 1) kel 0.20001 0.200 0.20 0.20 Note 2 2) V 15.000 15.0 15. 15. Model and Parameter Definition # Name Value Type From To Dep Start Stop 1) Dose = 100.0 1 0 1 0 0 0 2) kel = 0.2000 2 1 0 0 0 0 3) V = 15.00 18 1 1 0 0 0 Data for Cp :- DATA # Time Observed Calculated (Weight) Weighted residual 1 0.000 0.00000 6.66644 1.00000 0.00000 2 1.000 0.00000 5.45798 1.00000 0.00000 3 2.000 0.00000 4.46859 1.00000 0.00000 4 3.000 0.00000 3.65854 1.00000 0.00000 5 4.000 0.00000 2.99534 1.00000 0.00000 6 5.000 0.00000 2.45236 1.00000 0.00000 7 6.000 0.00000 2.00781 1.00000 0.00000 8 7.000 0.00000 1.64384 1.00000 0.00000 9 8.000 0.00000 1.34586 1.00000 0.00000 10 9.000 0.00000 1.10189 1.00000 0.00000 11 10.00 0.00000 0.902141 1.00000 0.00000 Plots of observed (*) and calculated values (+) versus time for Cp. Superimposed points (X) 6.666 Linear 6.666 Semi-log |+ |+ | | | | | | | | + | | | + | | | + | | | | | + | + | | | | | | + | + | | | | | + | + | | | | + | + | | | + | | | + | + | | + | | | + | + + | | | | | + | | |* * * * * * * * * * * | + |_____________________________________ |*__*___*__*___*___*__*___*__*___*___* 0.000 0.9021 0 <--> 10. 0 <--> 10. Sensitivity, Optimal Sampling Analysis Section For kel Max for line (A) Cp is 12.26 at 5.000 Note 3 Max 12.26 | AAAAAAAAAAAAAAAAAAA | AAAA AAAAA | AAA AAA | AA AAA | AA AAAA | AA AAAA | AA AAAA | A AA | AA AAA | A AAA | A AA | A | A | A | A | A | A | A | A | | A | A | | A | A | | A | A | | A | | A | | A | A | | A | | |A------------------------------------------------------------------------------ Min 0.000 0 10.00 For V Max for line (A) Cp is 0.4444 at 0.000 Note 3 Max 0.4444 |AA | A | A | A | A | AA | A | AA | A | A | AA | A | AA | A | AA | AA | AA | AA | AAA | AA | AAA | AA | AAA | AAA | AAA | AA | AAA | AAAA | AAAA | AAAA | AAAAA | AAAA | AAAAAAA | AAAAAA | | | | | |------------------------------------------------------------------------------- Min 0.000 0 10.00
This approach and result are essentially the same as for the graphical approach shown earlier.
Boomer Batch File
4 wls,bayes,sim,irwls,sim+error,grid Note 1
1 Screen, diskfile
f2121kelVka
1 Parameter type
Dose
100.0 Parameter value
0 Fixed,adjust,depend1,depend2
1 To
0 F-dependence ?
0 happy or not
2 Parameter type
ka
1.5000 Parameter value
1 Fixed,adjust,depend1,depend2 Note 2
1.49999
1.50001
2
0.01
2 To
1 From
0 happy or not
2 Parameter type
kel
0.2000 Parameter value
1 Fixed,adjust,depend1,depend2 Note 2
0.19999
0.20001
2
0.01
0 To
2 From
0 happy or not
18 Parameter type
V
15.00 Parameter value
1 Fixed,adjust,depend1,depend2 Note 2
14.999
15.001
2
0.01
1 To
Cp
2 From
0 happy or not
-1 Parameter type
2 Integration method
0.000 Relative error
0.000 Absolute error
Simulation kel varying
1 Data from disk or keyboard
0.000 X value
0.000 Y value
1.000 X value
0.000 Y value
2.000 X value
0.000 Y value
3.000 X value
0.000 Y value
4.000 X value
0.000 Y value
5.000 X value
0.000 Y value
6.000 X value
0.000 Y value
7.000 X value
0.000 Y value
8.000 X value
0.000 Y value
9.000 X value
0.000 Y value
10.00 X value
0.000 Y value
-1.000 X value
0 Accept, correct, delete, insert, of
0 Continue or save data
0 Error type for line
0 Weight type Note 3
0 AUC line number
10 Continue,save,plot,supplemental,sen Note 4
-1 wls,bayes,sim,irwls,sim+error,grid
Note 1 Select 'Simulation with random error or sensitivity analysis'
Note 2 Set parameters to be adjustable. Enter 'known' parameter values and set close upper and lower limits
Note 3 Select equal weight. Other weighting is possible but interpretation is curious
Note 4
Select option 10 for graphs and sensitivity
The output of this run is shown in Figure 21.4.4.
** FINAL OUTPUT FROM Boomer (v3.4.7) ** 16 February 2021 --- 12:06:23 pm Title: Simulation kel varying Input: From f2121kelvka.BAT Output: To f2121kelVka.OUT Data for Cp came from keyboard (or ?.BAT) Fitting algorithm: Simulation with Error Weighting for Cp by Equal weight Note 1 Numerical integration method: 2) Fehlberg RKF45 with 2 de(s) With relative error 0.1000E-03 With absolute error 0.1000E-03 This simulation took 0.1000E-01 seconds # Name Value Low Original High 1) ka 1.5000 1.50 1.5 1.5 Note 2 2) kel 0.20000 0.200 0.20 0.20 3) V 15.000 15.0 15. 15. Model and Parameter Definition # Name Value Type From To Dep Start Stop 1) Dose = 100.0 1 0 1 0 0 0 2) ka = 1.500 2 1 2 0 0 0 3) kel = 0.2000 2 2 0 0 0 0 4) V = 15.00 18 2 1 0 0 0 Data for Cp :- DATA # Time Observed Calculated (Weight) Weighted residual 1 0.000 0.00000 0.00000 0.00000 0.00000 2 1.000 0.00000 4.58151 1.00000 0.00000 3 2.000 0.00000 4.77330 1.00000 0.00000 4 3.000 0.00000 4.13613 1.00000 0.00000 5 4.000 0.00000 3.43726 1.00000 0.00000 6 5.000 0.00000 2.82554 1.00000 0.00000 7 6.000 0.00000 2.31588 1.00000 0.00000 8 7.000 0.00000 1.89665 1.00000 0.00000 9 8.000 0.00000 1.55296 1.00000 0.00000 10 9.000 0.00000 1.27148 1.00000 0.00000 11 10.00 0.00000 1.04101 1.00000 0.00000 Plots of observed (*) and calculated values (+) versus time for Cp. Superimposed points (X) 4.773 Linear 4.773 Semi-log | + | + | | + | + | | | + | | | + | | | | | + | | | + | | | | | + | | | + | | | | | + | + | | | | | | + | + | | | + | | | | + | + | + | | | | | | | + | | | | |X * * * * * * * * * * | + |_____________________________________ |X__*___*__*___*___*__*___*__*___*___* 0.000 1.041 0 <--> 10. 0 <--> 10. Sensitivity, Optimal Sampling Analysis Section For ka Max for line (A) Cp is -1.498 at 0.6000 Note 3 Max 0.2804 | AAAAAAAAAAAAAAAAAAAA | AA AAAAAAAAAA | AA AAAAAAAAAAA | A AAAAAAAAAAAA | A | AA |A------------------A----------------------------------------------------------- | | A | A | A | | A | A | | A | | A | A | A | | A | | | A | | A | A | A | | | A | | A A | | A | A | A | A A | A Min -1.498 0 10.00 For kel Max for line (A) Cp is 12.13 at 5.800 Note 3 Max 12.13 | AAAAAAAAAAAAAAAAA | AAA AAAAA | AAA AAAAA | AA AAAA | AA AAAA | AA AAA | A AAA | AA AA | A A | A | AA | A | A | A | A | A | A | A | A | A | | A | A | A | A | | A | A | A | | A | A | A | A | A | | AA | A | AA |A------------------------------------------------------------------------------ Min 0.000 0 10.00 For V Max for line (A) Cp is 0.3259 at 1.600 Note 3 Max 0.3259 | AAAAAAA | A A | A AA | A AA | AA | A AA | A | A AA | AA | A AA | A | A | A AA | AA | AA | AA | A AAA | AA | AAA | A | A AAA | AA | AA | AAA | AA | A AAA | AAA | AAA | AAAA | AAAA | AAAA | A | | | | | | | |A------------------------------------------------------------------------------ Min 0.000 0 10.00
Note 1 Equal weight selected
Note 2 Parameter values constrained at specified values
Note 3 Best time for ka is 0.6 hr, for kel is 5.8 hr and 1.6 hr for V. The resolution of this calculation is 1/100 the maximum time, here 0.1 hr.
This approach and result are essentially the same as for the graphical approach shown earlier.
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Copyright © 2001-2022 David W. A. Bourne (david@boomer.org)