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-rw-r--r--trunk/chemCal/R/loq.R40
1 files changed, 0 insertions, 40 deletions
diff --git a/trunk/chemCal/R/loq.R b/trunk/chemCal/R/loq.R
deleted file mode 100644
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--- a/trunk/chemCal/R/loq.R
+++ /dev/null
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-loq <- function(object, ..., alpha = 0.05, k = 3, n = 1, w.loq = "auto",
- var.loq = "auto")
-{
- UseMethod("loq")
-}
-
-loq.default <- function(object, ..., alpha = 0.05, k = 3, n = 1, w.loq = "auto",
- var.loq = "auto")
-{
- stop("loq is only implemented for univariate lm objects.")
-}
-
-loq.lm <- function(object, ..., alpha = 0.05, k = 3, n = 1, w.loq = "auto",
- var.loq = "auto")
-{
- if (length(object$weights) > 0 && var.loq == "auto" && w.loq == "auto") {
- stop(paste("If you are using a model from weighted regression,",
- "you need to specify a reasonable approximation for the",
- "weight (w.loq) or the variance (var.loq) at the",
- "limit of quantification"))
- }
- xname <- names(object$model)[[2]]
- yname <- names(object$model)[[1]]
- f <- function(x) {
- newdata <- data.frame(x = x)
- names(newdata) <- xname
- y <- predict(object, newdata)
- p <- inverse.predict(object, rep(y, n), ws = w.loq,
- var.s = var.loq, alpha = alpha)
- (p[["Prediction"]] - k * p[["Confidence"]])^2
- }
- tmp <- optimize(f,interval=c(0,max(object$model[[2]])))
- loq.x <- tmp$minimum
- newdata <- data.frame(x = loq.x)
- names(newdata) <- xname
- loq.y <- predict(object, newdata)
- loq <- list(loq.x, loq.y)
- names(loq) <- c(xname, yname)
- return(loq)
-}

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