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/dev/null and b/vignettes/figures/oetjen_bcell_single_live_cells.png differ diff --git a/vignettes/how_to_supercell.Rmd b/vignettes/how_to_create_supercells.Rmd similarity index 97% rename from vignettes/how_to_supercell.Rmd rename to vignettes/how_to_create_supercells.Rmd index bbbdf32..bf17897 100644 --- a/vignettes/how_to_supercell.Rmd +++ b/vignettes/how_to_create_supercells.Rmd @@ -35,25 +35,23 @@ In that case, please reach out through the github repository by creating a Githu # Installation -To install SuprCellCyto, we need to use the `devtools` package from CRAN. -You can install `devtools` by using the `install.packages("devtools")` command. +To install SuperCellCyto, we need to use the `remotes`` package from CRAN. +You can install `remotes` by using the `install.packages("remotes")` command. Thereafter, you can install SuperCellCyto using -`devtools::install_github("phipsonlab/SuperCellCyto")`. +`remotes::install_github("phipsonlab/SuperCellCyto")`. SuperCellCyto requires the [SuperCell R package](https://github.com/GfellerLab/SuperCell) installed to run properly. -If you use the `devtools::install_github` command above to install SuperCellCyto, +If you use the `remotes::install_github` command above to install SuperCellCyto, it should be, in theory, automatically installed. But in the case it doesn't, you can manually install it by using -`devtools::install_github("GfellerLab/SuperCell")`. +`remotes::install_github("GfellerLab/SuperCell")`. # Preparing your dataset The function which creates supercells is called `runSuperCellCyto`, and it operates on a `data.table` object, an enhanced version of R native `data.frame`. -We may add some support for `SummarizedExperiment` or `flowFrame` object -in the future if there are enough demands for it. If the raw data is stored in a csv file, we can import it into a `data.table` object using their `fread` function. diff --git a/vignettes/how_to_prepare_data.Rmd b/vignettes/how_to_prepare_data.Rmd new file mode 100644 index 0000000..15ed54a --- /dev/null +++ b/vignettes/how_to_prepare_data.Rmd @@ -0,0 +1,261 @@ +--- +title: "Preparing Data for SuperCellCyto" +author: "Givanna Putri" +output: + rmarkdown::html_vignette +vignette: > + %\VignetteIndexEntry{how_to_prepare_data} + %\VignetteEngine{knitr::rmarkdown} + %\VignetteEncoding{UTF-8} +--- + +```{r, include = FALSE} +knitr::opts_chunk$set( + collapse = TRUE, + comment = "#>" +) +``` + +## Performing Quality Control + +Prior to creating supercells, it's crucial to ensure that your dataset has +undergone thorough quality control (QC). +We want to retain only single, live cells and remove any debris, doublets, or dead cells. +Additionally, it is also important to perform compensation to correct for fluorescence spillover +(for Flow data) or to adjust for signal overlap or spillover between different metal isotopse (for Cytof data). +A well-prepared dataset is key to obtaining reliable supercells from SuperCellCyto. + +Several R packages are available for performing QC on cytometry data. +Notable among these are [PeacoQC](https://onlinelibrary.wiley.com/doi/10.1002/cyto.a.24501), +[CATALYST](https://bioconductor.org/packages/release/bioc/html/CATALYST.html), +and [CytoExploreR](https://dillonhammill.github.io/CytoExploreR/). +These packages are well maintained and are continuously updated. +To make sure that the information we provide do not quickly go out of date, we highly +recommend you to consult the packages' respective vignettes for detailed guidance on +how to use them to QC your data. + +If you prefer using manual gating to do QC, you can also use FlowJo. +For a comprehensive guide on using FlowJo for prepare your data, please read this +[vignette](https://wiki.centenary.org.au/display/SPECTRE/Exporting+data+from+FlowJo+for+analysis+in+Spectre). +The steps taken in that vignette to do QC is perfectly adequate for SuperCellCyto. + +In our manuscript, we used `CytoExploreR` to QC the `Oetjen_bcell` flow cytometry data +and `CATALYST` to QC the `Trussart_cytofruv` Cytof data. + +The specific scripts used can be found in our [Github repository](https://github.com/phipsonlab/SuperCellCyto-analysis/tree/master/code): + +1. `b_cell_identification/gate_flow_data.R` for `Oetjen_bcell` data. +2. `batch_correction/prepare_data.R` for `Trussart_cytofruv` data. +These scripts were adapted from those used in the [CytofRUV manuscript](https://elifesciences.org/articles/59630). + +For Oetjen_bcell data, we used the following gating strategy post compensation: + +1. FSC-H and FSC-A to isolate only the single events. (Also check SSC-H vs SSC-A). +2. FSC-A and SSC-A to remove debris. +3. Live/Dead and SSC-A to isolate live cells. + +The following is the resulting single live cells manually gated for the `Oetjen_bcell` data. + +```{r} +knitr::include_graphics("figures/oetjen_bcell_single_live_cells.png", error = FALSE) +``` + +After completing the QC process, you will have clean data in either CSV or FCS file formats. +The next section will guide you on how to load these files and proceed with preparing your data for SuperCellCyto. + +## Preparing FCS/CSV files for SuperCellCyto + +To use SuperCellCyto, your input data must be formatted as a [data.table](https://cran.r-project.org/web/packages/data.table/vignettes/datatable-intro.html) object. +Briefly, `data.table` is an enhanced version of R native `data.frame` object. +It is a package that offers fast processing of large `data.frame`. + +Additionally, each cell in your `data.table` must also have a unique identifier +and be associated with a sample, typically the biological sample it came from. + +### Preparing CSV files + +Loading CSV files into a `data.table` object is straightforward. +We can use the `fread` function from the `data.table` package. + +Here's how to install it: + +```{r eval=FALSE} +install.packages("data.table") +``` + +For this example, let's load two CSV files containing subsampled data from the +`Levine_32dim` dataset we used in SuperCellCyto manuscript. +Each file represents a sample (H1 and H2), with the sample name appended to the file name: + +```{r} +library(data.table) + +csv_files <- c("data/Levine_32dim_H1.csv", "data/Levine_32dim_H2.csv") +samples <- c("H1", "H2") + +dat <- lapply(seq(1: length(samples)), function(i) { + csv_file <- csv_files[i] + sample <- samples[i] + + dat_a_sample <- fread(csv_file) + dat_a_sample$sample <- sample + + return(dat_a_sample) +}) +dat <- rbindlist(dat) + +dat[, cell_id := paste0("Cell_", seq(1: nrow(dat)))] + +head(dat) +``` + +Let's break down what we have done: + +1. We specify the location of the csv files in `csv_files` vector +and their corresponding sample names in `samples` vector. +`data/Levine_32dim_H1.csv` belongs to sample H1 while `data/Levine_32dim_H2.csv` +belongs to sample H2. +2. We use `lapply` to simultaneously iterate over each element in the `csv_files` and `samples` vector. +For each csv file and the corresponding sample, we read the csv file into the variable +`dat_a_sample` using `fread` function. +We then assign the sample id in a new column called `sample`. +As a result, we get a list `dat` containing 2 `data.table` objects, 1 object per csv file. +3. We use `rbindlist` function from the `data.table` package to merge list into one `data.table` object. +4. We create a new column `cell_id` which gives each cell a unique id such as `Cell_1`, +`Cell_2`, etc. up until `Cell_2000` (we have in total 2,000 cells). + +### Preparing FCS files + +FCS files, commonly used in cytometry, require specific handling. +The [Spectre](https://github.com/immuneDynamics/Spectre/) package is an excellent tool for this purpose. + +You can install Spectre using the remotes package: + +```{r eval=FALSE} +install.packages("remotes") +remotes::install_github("immunedynamics/Spectre") +``` + +Let's load two FCS files from the `Trussart_cytofruv` dataset we used +in our manuscript. + +```{r} +library(Spectre) + +dat_list <- read.files(file.loc = "data", file.type = ".fcs") +class(dat_list) +names(dat_list) +class(dat_list$B2) +head(dat_list$B2) +``` + +Spectre's `read.files` reads FCS files into a list of `data.table` objects, +one for each file. +For each `data.table` object, it will also add a column `FileName` denoting the name of the file +the cell come from, which we can then use add sample information for the cells. + +For this dataset, both FCS files contain data belonging to a patient (let's call him B2). +The file with name "B2" contains the patient's sample quantified in batch 1, and +the file with name "Run3_B2" contains the patient's sample quantified in batch 2. +Let's name these samples "B2_batch1" and "B2_batch2". + +Now, let's merge `data.table` objects and add sample information. +We will use `rbindlist` to merge the list into one `data.table` object and then add +the sample information as a column. +The latter is done by first creating a new `data.table` object containing the mapping of +FileName and the sample name, and then using `merge.data.table` to add them into our `data.table` object. + +```{r} +dat_cytof <- rbindlist(dat_list) +sample_info <- data.table( + sample = c("B2_batch1", "B2_batch2"), + filename = c("B2", "Run3_B2") +) +dat_with_sample_info <- merge.data.table( + x = dat_cytof, + y = sample_info, + by.x = "FileName", + by.y = "filename" +) + +head(dat_with_sample_info) +``` + +We now should have the sample id for each cell. + +Now we need to create a new column `cell_id` which gives each cell a unique id such as `Cell_1`, +`Cell_2`, etc. + +```{r} +dat_with_sample_info[, cell_id := paste0("Cell_", seq(1: nrow(dat_with_sample_info)))] + +head(dat_with_sample_info) +``` + +With CSV and FCS files loaded as data.table objects, the next step is to transform +the data appropriately for SuperCellCyto. + +## Data Transformation + +Before using SuperCellCyto, it's essential to apply appropriate data transformations. +These transformations are crucial for accurate analysis, as explained in this +[article on data transformation](https://wiki.centenary.org.au/display/SPECTRE/Data+transformation). + +**Note**: If you have completed the QC process as outlined +[here](https://wiki.centenary.org.au/display/SPECTRE/Exporting+data+from+FlowJo+for+analysis+in+Spectre) +and have CSV files exported from FlowJo, you can proceed directly to the next vignette on +how to create supercells. +For more details on different file types (FCS, CSV scale, and CSV channel value), refer to this +[guide](https://wiki.centenary.org.au/display/SPECTRE/Exporting+data+from+FlowJo+for+analysis+in+Spectre). + +A common method for data transformation in cytometry is the arcsinh transformation, +an [inverse hyperbolic arcsinh transformation](https://mathworld.wolfram.com/InverseHyperbolicSine.html). +The transformation requires specifying a cofactor, which affects the representation of the low-end data. +Typically, a cofactor of 5 is used for Cytof data and 150 for Flow data. +This vignette will focus on the transformation process rather than cofactor selection. +For more in-depth information on choosing a cofactor, read this detailed +[article](https://wiki.centenary.org.au/display/SPECTRE/Data+transformation). + +We'll use the `Levine_32dim` dataset loaded earlier from CSV files: + +```{r} +head(dat) +``` + +First, we need to select the markers to be transformed. +Usually, all markers should be transformed for SuperCellCyto. +However, you can choose to exclude specific markers if needed: + +```{r} +markers_to_transform <- c("CD45RA","CD133","CD19","CD22","CD11b","CD4", + "CD8","CD34","Flt3","CD20","CXCR4","CD235ab", + "CD45","CD123","CD321","CD14","CD33","CD47","CD11c", + "CD7","CD15","CD16","CD44","CD38","CD13","CD3","CD61", + "CD117","CD49d","HLA-DR","CD64","CD41") +``` + +For transformation, we'll use a cofactor of 5 and apply the arcsinh transformation +using the Spectre package. +If Spectre isn't installed, use: + +```{r eval=FALSE} +install.packages("remotes") +remotes::install_github("immunedynamics/Spectre") +``` + +Perform the transformation: + +```{r} +dat <- do.asinh(dat, markers_to_transform, cofactor = 5) +head(dat) +``` + +After transformation, new columns with "_asinh" appended indicate the transformed markers. + +With your data now transformed, you're ready to create supercells using SuperCellCyto. +Please refer to our dedicated vignette for detailed instructions. + + + + + diff --git a/vignettes/how_to_supercell.R b/vignettes/how_to_supercell.R deleted file mode 100644 index 4165b41..0000000 --- a/vignettes/how_to_supercell.R +++ /dev/null @@ -1,85 +0,0 @@ -## ---- include = FALSE, echo=FALSE, results="hide", message=FALSE-------------- -knitr::opts_chunk$set( - collapse = TRUE, - comment = "#>" -) - -## ----setup, echo=FALSE, message=FALSE----------------------------------------- -library(SuperCellCyto) -library(parallel) - -## ----------------------------------------------------------------------------- -n_markers <- 15 -n_samples <- 3 -dat <- SuperCellCyto::simCytoData(nmarkers = n_markers, ncells = rep(10000, n_samples)) -head(dat) - -## ----------------------------------------------------------------------------- -# Specify which columns are the markers to transform -marker_cols <- paste0("Marker_", seq_len(n_markers)) -# The co-factor for arc-sinh -cofactor <- 5 - -# Do the transformation -dat_asinh <- asinh(dat[, marker_cols, with = FALSE] / cofactor) - -# Rename the new columns -marker_cols_asinh <- paste0(marker_cols, "_asinh") -names(dat_asinh) <- marker_cols_asinh - -# Add them our previously loaded data -dat <- cbind(dat, dat_asinh) - -head(dat[, marker_cols_asinh, with = FALSE]) - -## ----------------------------------------------------------------------------- -head(dat$Cell_Id, n = 10) - -## ----------------------------------------------------------------------------- -dat$Cell_id_dummy <- paste0("Cell_", seq_len(nrow(dat))) -head(dat$Cell_id_dummy, n = 10) - -## ----------------------------------------------------------------------------- -unique(dat$Sample) - -## ----------------------------------------------------------------------------- -table(dat$Sample) - -## ----------------------------------------------------------------------------- -markers_col <- paste0("Marker_", seq_len(n_markers), "_asinh") -sample_col <- "Sample" -cell_id_col <- "Cell_Id_dummy" - -## ----------------------------------------------------------------------------- -supercells <- runSuperCellCyto( - dt = dat, - markers = markers_col, - sample_colname = sample_col, - cell_id_colname = cell_id_col -) - -## ----------------------------------------------------------------------------- -class(supercells) - -## ----------------------------------------------------------------------------- -names(supercells) - -## ----------------------------------------------------------------------------- -head(supercells$supercell_expression_matrix) - -## ----------------------------------------------------------------------------- -names(supercells$supercell_expression_matrix) - -## ----------------------------------------------------------------------------- -head(unique(supercells$supercell_expression_matrix$SuperCellId)) - -## ----------------------------------------------------------------------------- -supercell_ids <- unique(supercells$supercell_expression_matrix$SuperCellId) -supercell_ids[grep("SuperCell_1_", supercell_ids)] - -## ----------------------------------------------------------------------------- -head(supercells$supercell_cell_map) - -## ----------------------------------------------------------------------------- -n_cores <- detectCores() - diff --git a/vignettes/supercellcyto.png b/vignettes/supercellcyto.png deleted file mode 100644 index 86c8fb2..0000000 Binary files a/vignettes/supercellcyto.png and /dev/null differ