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Merge pull request #43 from jasenfinch/devel
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v0.7.8
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jasenfinch committed Apr 20, 2021
2 parents d5c5b46 + 9755538 commit 5b2df43
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Showing 3 changed files with 11 additions and 8 deletions.
2 changes: 1 addition & 1 deletion DESCRIPTION
@@ -1,6 +1,6 @@
Package: MFassign
Title: Molecular Formula Assignment for High Resolution metabolomics
Version: 0.7.7
Version: 0.7.8
Authors@R: person("Jasen", "Finch", email = "jsf9@aber.ac.uk", role = c("aut", "cre"))
Description: Molecular formula assignment for high resolution metabolomics.
Depends: R (>= 3.5.0),
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4 changes: 2 additions & 2 deletions NAMESPACE
Expand Up @@ -83,9 +83,9 @@ importFrom(magrittr,set_names)
importFrom(magrittr,set_rownames)
importFrom(metabolyseR,analysisData)
importFrom(metabolyseR,analysisParameters)
importFrom(metabolyseR,correlationResults)
importFrom(metabolyseR,analysisResults)
importFrom(metabolyseR,dat)
importFrom(metabolyseR,keepVariables)
importFrom(metabolyseR,keepFeatures)
importFrom(metabolyseR,metabolyse)
importFrom(metabolyseR,sinfo)
importFrom(methods,new)
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13 changes: 8 additions & 5 deletions R/calcCorrelations-method.R
@@ -1,4 +1,4 @@
#' @importFrom metabolyseR analysisParameters metabolyse correlationResults keepVariables analysisData dat sinfo
#' @importFrom metabolyseR analysisParameters metabolyse analysisResults keepFeatures analysisData dat sinfo
#' @importFrom magrittr set_rownames
#' @importFrom stats cutree dist hclust

Expand Down Expand Up @@ -38,16 +38,19 @@ setMethod('calcCorrelations',signature = 'Assignment',function(assignment){
split(.$Group) %>%
parLapply(cl = clus,function(f){
analysisData(assignment@data,tibble(ID = 1:nrow(assignment@data))) %>%
keepVariables(variables = f$Feature) %>%
keepFeatures(features = f$Feature) %>%
{metabolyse(dat(.),sinfo(.),p,verbose = FALSE)} %>%
correlationResults()
analysisResults(element = 'correlations')
}) %>%
bind_rows(.id = 'RT Group')
stopCluster(clus)

} else {
cors <- metabolyse(assignment@data,tibble(ID = 1:nrow(assignment@data)),p,verbose = F) %>%
correlationResults()
cors <- metabolyse(assignment@data,
tibble(ID = 1:nrow(assignment@data)),
p,
verbose = FALSE) %>%
analysisResults(element = 'correlations')
}

assignment@correlations <- cors
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