From 89cd81cf47c9f05831e854d5185b5cc599745db4 Mon Sep 17 00:00:00 2001
From: Johannes Ranke
## mkin version: 0.9.34
-## R version: 3.1.2
-## Date of fit: Thu Dec 18 09:52:49 2014
-## Date of summary: Thu Dec 18 09:52:49 2014
+## mkin version: 0.9.35
+## R version: 3.2.0
+## Date of fit: Fri May 15 13:29:55 2015
+## Date of summary: Fri May 15 13:29:55 2015
##
## Equations:
## d_parent = - k_parent_sink * parent
##
## Model predictions using solution type analytical
##
-## Fitted with method Port using 37 model solutions performed in 0.214 s
+## Fitted with method Port using 37 model solutions performed in 0.082 s
##
## Weighting: none
##
@@ -323,13 +323,13 @@ summary(m.L1.SFO)
plot(m.L1.SFO)
-
+
The residual plot can be easily obtained by
mkinresplot(m.L1.SFO, ylab = "Observed", xlab = "Time")
-
+
For comparison, the FOMC model is fitted as well, and the chi2 error level
is checked.
@@ -344,10 +344,10 @@ is checked.
summary(m.L1.FOMC, data = FALSE)
-## mkin version: 0.9.34
-## R version: 3.1.2
-## Date of fit: Thu Dec 18 09:52:50 2014
-## Date of summary: Thu Dec 18 09:52:50 2014
+## mkin version: 0.9.35
+## R version: 3.2.0
+## Date of fit: Fri May 15 13:29:55 2015
+## Date of summary: Fri May 15 13:29:55 2015
##
##
## Warning: Optimisation by method Port did not converge.
@@ -359,7 +359,7 @@ is checked.
##
## Model predictions using solution type analytical
##
-## Fitted with method Port using 188 model solutions performed in 1.085 s
+## Fitted with method Port using 188 model solutions performed in 0.412 s
##
## Weighting: none
##
@@ -443,17 +443,17 @@ FOCUS_2006_L2_mkin <- mkin_wide_to_long(FOCUS_2006_L2)
summary(m.L2.SFO)
-## mkin version: 0.9.34
-## R version: 3.1.2
-## Date of fit: Thu Dec 18 09:52:51 2014
-## Date of summary: Thu Dec 18 09:52:51 2014
+## mkin version: 0.9.35
+## R version: 3.2.0
+## Date of fit: Fri May 15 13:29:56 2015
+## Date of summary: Fri May 15 13:29:56 2015
##
## Equations:
## d_parent = - k_parent_sink * parent
##
## Model predictions using solution type analytical
##
-## Fitted with method Port using 41 model solutions performed in 0.238 s
+## Fitted with method Port using 41 model solutions performed in 0.091 s
##
## Weighting: none
##
@@ -527,7 +527,7 @@ plot(m.L2.SFO)
mkinresplot(m.L2.SFO)
-
+
In the FOCUS kinetics report, it is stated that there is no apparent systematic
error observed from the residual plot up to the measured DT90 (approximately at
@@ -548,22 +548,22 @@ plot(m.L2.FOMC)
mkinresplot(m.L2.FOMC)
-
+
summary(m.L2.FOMC, data = FALSE)
-## mkin version: 0.9.34
-## R version: 3.1.2
-## Date of fit: Thu Dec 18 09:52:51 2014
-## Date of summary: Thu Dec 18 09:52:51 2014
+## mkin version: 0.9.35
+## R version: 3.2.0
+## Date of fit: Fri May 15 13:29:56 2015
+## Date of summary: Fri May 15 13:29:56 2015
##
## Equations:
## d_parent = - (alpha/beta) * ((time/beta) + 1)^-1 * parent
##
## Model predictions using solution type analytical
##
-## Fitted with method Port using 81 model solutions performed in 0.464 s
+## Fitted with method Port using 81 model solutions performed in 0.192 s
##
## Weighting: none
##
@@ -622,7 +622,7 @@ experimental error has to be assumed in order to explain the data.
plot(m.L2.DFOP)
-
+
Here, the default starting parameters for the DFOP model obviously do not lead
to a reasonable solution. Therefore the fit is repeated with different starting
@@ -634,15 +634,15 @@ parameters.
plot(m.L2.DFOP)
-
+
summary(m.L2.DFOP, data = FALSE)
-## mkin version: 0.9.34
-## R version: 3.1.2
-## Date of fit: Thu Dec 18 09:52:56 2014
-## Date of summary: Thu Dec 18 09:52:56 2014
+## mkin version: 0.9.35
+## R version: 3.2.0
+## Date of fit: Fri May 15 13:29:58 2015
+## Date of summary: Fri May 15 13:29:58 2015
##
## Equations:
## d_parent = - ((k1 * g * exp(-k1 * time) + k2 * (1 - g) * exp(-k2 *
@@ -651,7 +651,7 @@ plot(m.L2.DFOP)
##
## Model predictions using solution type analytical
##
-## Fitted with method Port using 336 model solutions performed in 1.986 s
+## Fitted with method Port using 336 model solutions performed in 0.775 s
##
## Weighting: none
##
@@ -723,22 +723,22 @@ FOCUS_2006_L3_mkin <- mkin_wide_to_long(FOCUS_2006_L3)
plot(m.L3.SFO)
-
+
summary(m.L3.SFO)
-## mkin version: 0.9.34
-## R version: 3.1.2
-## Date of fit: Thu Dec 18 09:52:56 2014
-## Date of summary: Thu Dec 18 09:52:56 2014
+## mkin version: 0.9.35
+## R version: 3.2.0
+## Date of fit: Fri May 15 13:29:58 2015
+## Date of summary: Fri May 15 13:29:58 2015
##
## Equations:
## d_parent = - k_parent_sink * parent
##
## Model predictions using solution type analytical
##
-## Fitted with method Port using 43 model solutions performed in 0.246 s
+## Fitted with method Port using 43 model solutions performed in 0.099 s
##
## Weighting: none
##
@@ -809,22 +809,22 @@ does not fit very well.
plot(m.L3.FOMC)
-
+
summary(m.L3.FOMC, data = FALSE)
-## mkin version: 0.9.34
-## R version: 3.1.2
-## Date of fit: Thu Dec 18 09:52:57 2014
-## Date of summary: Thu Dec 18 09:52:57 2014
+## mkin version: 0.9.35
+## R version: 3.2.0
+## Date of fit: Fri May 15 13:29:58 2015
+## Date of summary: Fri May 15 13:29:58 2015
##
## Equations:
## d_parent = - (alpha/beta) * ((time/beta) + 1)^-1 * parent
##
## Model predictions using solution type analytical
##
-## Fitted with method Port using 83 model solutions performed in 0.475 s
+## Fitted with method Port using 83 model solutions performed in 0.186 s
##
## Weighting: none
##
@@ -882,15 +882,15 @@ considerably:
plot(m.L3.DFOP)
-
+
summary(m.L3.DFOP, data = FALSE)
-## mkin version: 0.9.34
-## R version: 3.1.2
-## Date of fit: Thu Dec 18 09:52:58 2014
-## Date of summary: Thu Dec 18 09:52:58 2014
+## mkin version: 0.9.35
+## R version: 3.2.0
+## Date of fit: Fri May 15 13:29:59 2015
+## Date of summary: Fri May 15 13:29:59 2015
##
## Equations:
## d_parent = - ((k1 * g * exp(-k1 * time) + k2 * (1 - g) * exp(-k2 *
@@ -899,7 +899,7 @@ plot(m.L3.DFOP)
##
## Model predictions using solution type analytical
##
-## Fitted with method Port using 137 model solutions performed in 0.813 s
+## Fitted with method Port using 137 model solutions performed in 0.314 s
##
## Weighting: none
##
@@ -980,22 +980,22 @@ FOCUS_2006_L4_mkin <- mkin_wide_to_long(FOCUS_2006_L4)
plot(m.L4.SFO)
-
+
summary(m.L4.SFO, data = FALSE)
-## mkin version: 0.9.34
-## R version: 3.1.2
-## Date of fit: Thu Dec 18 09:52:58 2014
-## Date of summary: Thu Dec 18 09:52:58 2014
+## mkin version: 0.9.35
+## R version: 3.2.0
+## Date of fit: Fri May 15 13:29:59 2015
+## Date of summary: Fri May 15 13:29:59 2015
##
## Equations:
## d_parent = - k_parent_sink * parent
##
## Model predictions using solution type analytical
##
-## Fitted with method Port using 46 model solutions performed in 0.264 s
+## Fitted with method Port using 46 model solutions performed in 0.109 s
##
## Weighting: none
##
@@ -1055,22 +1055,22 @@ fits very well.
plot(m.L4.FOMC)
-
+
summary(m.L4.FOMC, data = FALSE)
-## mkin version: 0.9.34
-## R version: 3.1.2
-## Date of fit: Thu Dec 18 09:52:59 2014
-## Date of summary: Thu Dec 18 09:52:59 2014
+## mkin version: 0.9.35
+## R version: 3.2.0
+## Date of fit: Fri May 15 13:29:59 2015
+## Date of summary: Fri May 15 13:29:59 2015
##
## Equations:
## d_parent = - (alpha/beta) * ((time/beta) + 1)^-1 * parent
##
## Model predictions using solution type analytical
##
-## Fitted with method Port using 66 model solutions performed in 0.375 s
+## Fitted with method Port using 66 model solutions performed in 0.146 s
##
## Weighting: none
##
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