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-rw-r--r--R/mkinerrmin.R29
1 files changed, 20 insertions, 9 deletions
diff --git a/R/mkinerrmin.R b/R/mkinerrmin.R
index 671bcaab..9ebac6a4 100644
--- a/R/mkinerrmin.R
+++ b/R/mkinerrmin.R
@@ -48,6 +48,7 @@ mkinerrmin <- function(fit, alpha = 0.05)
n.optim = errmin.overall$n.optim, df = errmin.overall$df)
rownames(errmin) <- "All data"
+ # The degrees of freedom are counted according to FOCUS kinetics (2011, p. 164)
for (obs_var in fit$obs_vars)
{
errdata.var <- subset(errdata, name == obs_var)
@@ -57,21 +58,31 @@ mkinerrmin <- function(fit, alpha = 0.05)
# Rate constants are attributed to the source variable
n.k.optim <- length(grep(paste("^k", obs_var, sep="_"), names(parms.optim)))
-
- # Formation fractions are attributed to the target variable
- n.ff.optim <- length(grep(paste("^f", ".*", obs_var, "$", sep=""), names(parms.optim)))
+ n.k.optim <- n.k.optim + length(grep(paste("^log_k", obs_var, sep="_"),
+ names(parms.optim)))
+
+ n.ff.optim <- 0
+ # Formation fractions are attributed to the target variable, so look
+ # for source compartments with formation fractions
+ for (source_var in fit$obs_vars) {
+ for (target_var in fit$mkinmod$spec[[source_var]]$to) {
+ if (obs_var == target_var) {
+ n.ff.optim <- n.ff.optim +
+ length(grep(paste("^f", source_var, sep = "_"),
+ names(parms.optim)))
+ }
+ }
+ }
n.optim <- n.k.optim + n.initials.optim + n.ff.optim
# FOMC, DFOP and HS parameters are only counted if we are looking at the
# first variable in the model which is always the source variable
if (obs_var == fit$obs_vars[[1]]) {
- if ("alpha" %in% names(parms.optim)) n.optim <- n.optim + 1
- if ("beta" %in% names(parms.optim)) n.optim <- n.optim + 1
- if ("k1" %in% names(parms.optim)) n.optim <- n.optim + 1
- if ("k2" %in% names(parms.optim)) n.optim <- n.optim + 1
- if ("g" %in% names(parms.optim)) n.optim <- n.optim + 1
- if ("tb" %in% names(parms.optim)) n.optim <- n.optim + 1
+ special_parms = c("alpha", "log_alpha", "beta", "log_beta",
+ "k1", "log_k1", "k2", "log_k2",
+ "g", "g_ilr", "tb", "log_tb")
+ n.optim <- n.optim + length(intersect(special_parms, names(parms.optim)))
}
# Calculate and add a line to the results

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