Mercurial > repos > computational-metabolomics > mspurity_createdatabase
diff purityX.R @ 9:751b7378a683 draft
planemo upload for repository https://github.com/computational-metabolomics/mspurity-galaxy commit 20a48a1862267264f98b7c514287f9a5cba1143f
author | computational-metabolomics |
---|---|
date | Thu, 13 Jun 2024 11:39:21 +0000 |
parents | efd14b326007 |
children | f5043704dd62 |
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--- a/purityX.R Wed Jun 12 16:05:01 2024 +0000 +++ b/purityX.R Thu Jun 13 11:39:21 2024 +0000 @@ -74,14 +74,18 @@ getxcmsSetObject <- function(xobject) { # XCMS 1.x - if (class(xobject) == "xcmsSet") { + if (class(xobject) == "xcmsSet"){ return(xobject) } # XCMS 3.x if (class(xobject) == "XCMSnExp") { # Get the legacy xcmsSet object suppressWarnings(xset <- as(xobject, "xcmsSet")) - sampclass(xset) <- xset@phenoData$sample_group + if (!is.null(xset@phenoData$sample_group)){ + xcms::sampclass(xset) <- xset@phenoData$sample_group + }else{ + xcms::sampclass(xset) <- "." + } return(xset) } }