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authorJohannes Ranke <jranke@uni-bremen.de>2016-09-27 23:00:48 +0200
committerJohannes Ranke <jranke@uni-bremen.de>2016-09-27 23:00:48 +0200
commit12a31f4c130c551f82232d9ef7dfb608bd52c53f (patch)
tree2525ab1ea4102a6edddbd0c2f03f4a851bf2f9c5 /R/endpoint.R
parent0d958ab6f84b569b5437f231c56004890c4ae23b (diff)
Reorganise repository using standard package layout
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+#' Retrieve endpoint information from the chyaml field of a chent object
+#'
+#' R6 class objects of class chent represent chemical entities
+#' and can hold a list of information loaded from a chemical yaml file in their
+#' chyaml field. Such information is extracted and optionally aggregated by
+#' this function.
+#'
+#' The functions \code{soil_*} are functions to extract soil specific endpoints.
+#' For the Freundlich exponent, the capital letter \code{N} is used in order to
+#' facilitate dealing with such data in R. In pesticide fate modelling, this
+#' exponent is often called 1/n.
+#'
+#' @export
+#' @param chent The chent object to get the information from
+#' @param medium The medium for which information is sought
+#' @param type The information type
+#' @param lab_field If not NA, do we want laboratory or field endpoints
+#' @param redox If not NA, are we looking for aerobic or anaerobic data
+#' @param value The name of the value we want. The list given in the
+#' usage section is not exclusive
+#' @param aggregator The aggregator function. Can be mean,
+#' \code{\link{geomean}}, or identity, for example.
+#' @param raw Should the number(s) be returned as stored in the chent
+#' object (could be a character value) to retain original information
+#' about precision?
+#' @param signif How many significant digits do we want
+#' @return The result from applying the aggregator function to
+#' the values converted to a numeric vector, rounded to the
+#' given number of significant digits, or, if raw = TRUE,
+#' the values as a character value, retaining any implicit
+#' information on precision that may be present.
+#'
+endpoint <- function(chent,
+ medium = "soil",
+ type = c("degradation", "sorption"),
+ lab_field = c(NA, "laboratory", "field"),
+ redox = c(NA, "aerobic", "anaerobic"),
+ value = c("DT50ref", "Kfoc", "N"),
+ aggregator = geomean,
+ raw = FALSE,
+ signif = 3)
+{
+ if (!is(chent, "chent")) {
+ stop("Please supply a chent object as created using the package 'chents' available from jrwb.de")
+ }
+ ep_list <- chent$chyaml[[medium]][[type]]
+ if (!is.na(lab_field[1])) {
+ ep_list <- ep_list[[lab_field]]
+ }
+ if (!is.na(redox[1])) {
+ ep_list <- ep_list[[redox]]
+ }
+ values <- ep_list$data[[value]]
+ if (raw) return(values)
+ else return(signif(aggregator(as.numeric(values)), signif))
+}
+
+#' @inheritParams endpoint
+#' @rdname endpoint
+#' @export
+soil_DT50 <- function(chent, aggregator = geomean, signif = 3,
+ lab_field = "laboratory", value = "DT50ref",
+ redox = "aerobic", raw = FALSE) {
+ ep <- endpoint(chent, medium = "soil", type = "degradation",
+ lab_field = "laboratory", redox = redox,
+ signif = signif,
+ value = value, aggregator = aggregator, raw = raw)
+ return(ep)
+}
+
+#' @inheritParams endpoint
+#' @rdname endpoint
+#' @export
+soil_Kfoc <- function(chent, aggregator = geomean, signif = 3,
+ value = "Kfoc", raw = FALSE) {
+ ep <- endpoint(chent, medium = "soil", type = "sorption",
+ signif = signif,
+ value = value, aggregator = aggregator, raw = raw)
+ return(ep)
+}
+
+#' @inheritParams endpoint
+#' @rdname endpoint
+#' @export
+soil_N <- function(chent, aggregator = mean, signif = 3, raw = FALSE) {
+ ep <- endpoint(chent, medium = "soil", type = "sorption",
+ signif = signif,
+ value = "N", aggregator = aggregator, raw = raw)
+ return(ep)
+}
+
+#' @inheritParams endpoint
+#' @rdname endpoint
+#' @param values The values to be returned
+#' @param aggregators A named vector of aggregator functions to be used
+#' @export
+soil_sorption <- function(chent, values = c("Kfoc", "N"),
+ aggregators = c(Kfoc = geomean, Koc = geomean, N = mean),
+ signif = c(Kfoc = 3, N = 3),
+ raw = FALSE) {
+ res <- sapply(values,
+ function(x) {
+ endpoint(chent, medium = "soil", type = "sorption",
+ signif = signif[[x]],
+ value = x, aggregator = aggregators[[x]], raw = raw)
+ }
+ )
+ return(res)
+}

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