R/DATA-demo_chemicals.R

#' @title Demo chemicals
#' @description Small data set of five chemicals and their InChIKey for demonstration purposes.
#' @details These five chemicals were chosen randomly. The verified InChIKeys were extracted from Wikipedia pages.
#' @docType data
#' @usage data(demo_chemicals)
#' @format A 5-by-2 \code{data.frame}.
#' @keywords datasets
#' @author Raoul Wolf (\url{https://github.com/RaoulWolf/})
#' @examples 
#' data(demo_chemicals)
#' demo_chemicals
"demo_chemicals"
NIVANorge/chemspideR documentation built on Jan. 8, 2021, 7:48 a.m.