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+\name{mccall81_245T}
+\alias{mccall81_245T}
+\docType{data}
+\title{
+ Datasets on aerobic soil metabolism of 2,4,5-T in six soils
+}
+\description{
+ Time course of 2,4,5-trichlorophenoxyacetic acid, and the corresponding
+ 2,4,5-trichlorophenol and 2,4,5-trichloroanisole as recovered in diethylether
+ extracts.
+}
+\usage{mccall81_245T}
+\format{
+ A dataframe containing the following variables.
+ \describe{
+ \item{\code{name}}{the name of the compound observed. Note that T245 is used as
+ an acronym for 2,4,5-T. T245 is a legitimate object name
+ in R, which is necessary for specifying models using
+ \code{\link{mkinmod}}.}
+ \item{\code{time}}{a numeric vector containing sampling times in days after
+ treatment}
+ \item{\code{value}}{a numeric vector containing concentrations in percent of applied radioactivity}
+ \item{\code{soil}}{a factor containing the name of the soil}
+ }
+}
+\source{
+ McCall P, Vrona SA, Kelley SS (1981) Fate of uniformly carbon-14 ring labeled 2,4,5-Trichlorophenoxyacetic acid and 2,4-dichlorophenoxyacetic acid. J Agric Chem 29, 100-107
+ \url{http://dx.doi.org/10.1021/jf00103a026}
+}
+\examples{
+ SFO_SFO_SFO <- mkinmod(T245 = list(type = "SFO", to = "phenol"),
+ phenol = list(type = "SFO", to = "anisole"),
+ anisole = list(type = "SFO"))
+ \dontrun{fit.1 <- mkinfit(SFO_SFO_SFO, subset(mccall81_245T, soil == "Commerce"))
+ summary(fit.1, data = FALSE)}
+ # No covariance matrix and k_phenol_sink is really small, therefore fix it to zero
+ fit.2 <- mkinfit(SFO_SFO_SFO, subset(mccall81_245T, soil == "Commerce"),
+ parms.ini = c(k_phenol_sink = 0),
+ fixed_parms = "k_phenol_sink")
+ summary(fit.2, data = FALSE)
+}
+\keyword{datasets}

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