% Generated by roxygen2: do not edit by hand % Please edit documentation in R/loq.R \name{loq} \alias{loq} \alias{loq.lm} \alias{loq.rlm} \alias{loq.default} \title{Estimate a limit of quantification (LOQ)} \usage{ loq( object, ..., alpha = 0.05, k = 3, n = 1, w.loq = "auto", var.loq = "auto", tol = "default" ) } \arguments{ \item{object}{A univariate model object of class \code{\link{lm}} or \code{\link[MASS:rlm]{rlm}} with model formula \code{y ~ x} or \code{y ~ x - 1}, optionally from a weighted regression. If weights are specified in the model, either \code{w.loq} or \code{var.loq} have to be specified.} \item{\dots}{Placeholder for further arguments that might be needed by future implementations.} \item{alpha}{The error tolerance for the prediction of x values in the calculation.} \item{k}{The inverse of the maximum relative error tolerated at the desired LOQ.} \item{n}{The number of replicate measurements for which the LOQ should be specified.} \item{w.loq}{The weight that should be attributed to the LOQ. Defaults to one for unweighted regression, and to the mean of the weights for weighted regression. See \code{\link{massart97ex3}} for an example how to take advantage of knowledge about the variance function.} \item{var.loq}{The approximate variance at the LOQ. The default value is calculated from the model.} \item{tol}{The default tolerance for the LOQ on the x scale is the value of the smallest non-zero standard divided by 1000. Can be set to a numeric value to override this.} } \value{ The estimated limit of quantification for a model used for calibration. } \description{ The limit of quantification is the x value, where the relative error of the quantification given the calibration model reaches a prespecified value 1/k. Thus, it is the solution of the equation \deqn{L = k c(L)}{L = k * c(L)} where c(L) is half of the length of the confidence interval at the limit L (DIN 32645, equivalent to ISO 11843). c(L) is internally estimated by \code{\link{inverse.predict}}, and L is obtained by iteration. } \note{ \itemize{ \item IUPAC recommends to base the LOQ on the standard deviation of the signal where x = 0. \item The calculation of a LOQ based on weighted regression is non-standard and therefore not tested. Feedback is welcome. } } \examples{ m <- lm(y ~ x, data = massart97ex1) loq(m) # We can get better by using replicate measurements loq(m, n = 3) } \seealso{ Examples for \code{\link{din32645}} }