--- title: "Generate QC Report" output: rmarkdown::html_vignette vignette: > %\VignetteIndexEntry{Generate QC Report} %\VignetteEngine{knitr::rmarkdown} %\VignetteEncoding{UTF-8} --- ```{r, include = FALSE} knitr::opts_chunk$set( collapse = TRUE, comment = "#>" ) ``` ## Import example metabolomics data ```{r render} library(metaboprep) # import data directly as a Metaboprep object mydata <- read_metabolon(system.file("extdata", "metabolon_v1.1_example.xlsx", package = "metaboprep"), sheet="OrigScale", return_Metaboprep = TRUE) ``` ## Identify the Xenobiotics to exclude from the QC steps ```{r xeno_identification} xenos <- mydata@features[mydata@features$pathway == "xenobiotic", "feature_id"] ## how many xenobiotics identified length(xenos) ``` ## QC the example Metabolon data ```{r qc} mydata <- mydata |> quality_control(source_layer = "input", sample_missingness = 0.2, feature_missingness = 0.2, total_peak_area_sd = 5, outlier_udist = 5, outlier_treatment = "leave_be", winsorize_quantile = 1.0, tree_cut_height = 0.5, pc_outlier_sd = 5, feature_selection = "least_missingness", features_exclude_but_keep = xenos ) ``` ## Generate the metaboprep report ```{r} # render report generate_report(mydata, project = "myproject", output_dir = getwd(), output_filename = NULL, format = "html", template = "qc_report") ``` ```{r, echo=FALSE} file.copy(file.path(getwd(), "myproject_metaboprep_qc_report.html"), file.path(getwd(), "../docs/articles/myproject_metaboprep_qc_report.html"), overwrite = TRUE) ``` ```{r, echo=FALSE, results="asis"} cat('