schaefer07_complex_case. mkin 0.9.44.9000

Usage

data(schaefer07_complex_case)

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Description

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This dataset was used for a comparison of KinGUI and ModelMaker to check the - software quality of KinGUI in the original publication (Schäfer et al., 2007). - The results from the fitting are also included.

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Format

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The data set is a data frame with 8 observations on the following 6 variables. -

time: a numeric vector
parent: a numeric vector
A1: a numeric vector
B1: a numeric vector
C1: a numeric vector
A2: a numeric vector

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The results are a data frame with 14 results for different parameter values

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References

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Schäfer D, Mikolasch B, Rainbird P and Harvey B (2007). KinGUI: a new kinetic - software tool for evaluations according to FOCUS degradation kinetics. In: Del - Re AAM, Capri E, Fragoulis G and Trevisan M (Eds.). Proceedings of the XIII - Symposium Pesticide Chemistry, Piacenza, 2007, p. 916-923.

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Examples

data <- mkin_wide_to_long(schaefer07_complex_case, time = "time")
-model <- mkinmod(
-  parent = list(type = "SFO", to = c("A1", "B1", "C1"), sink = FALSE),
-  A1 = list(type = "SFO", to = "A2"),
-  B1 = list(type = "SFO"),
-  C1 = list(type = "SFO"),
-  A2 = list(type = "SFO"), use_of_ff = "max")
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-Successfully compiled differential equation model from auto-generated C code.
-## Not run: mkinfit(model, data, plot=TRUE)
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- Metabolism data set used for checking the software quality of KinGUI -

Usage

Description

Format

References

Examples