Mercurial > repos > lecorguille > xcms_fillpeaks
diff abims_xcms_fillPeaks.xml @ 29:f6d3e6be4ea3 draft
planemo upload for repository https://github.com/workflow4metabolomics/xcms commit bff1445c9b00ccdbe05ee3dc6ed24221033384b9
| author | lecorguille |
|---|---|
| date | Tue, 24 Oct 2017 11:48:31 -0400 |
| parents | 0544bc5967ed |
| children | 6b5ed508f81f |
line wrap: on
line diff
--- a/abims_xcms_fillPeaks.xml Mon Apr 03 07:53:30 2017 -0400 +++ b/abims_xcms_fillPeaks.xml Tue Oct 24 11:48:31 2017 -0400 @@ -117,7 +117,6 @@ Xcms.fillPeaks ============== ------------ Description ----------- @@ -134,18 +133,17 @@ ------------------ Workflow position ----------------- **Upstream tools** -========================= ================= ================== ========== -Name output file format parameter -========================= ================= ================== ========== -xcms.group xset.group.RData rdata.xcms.group RData file -========================= ================= ================== ========== ++------------------------+------------------+--------------------+------------+ +| Name | output file | format | parameter | ++========================+==================+====================+============+ +| xcms.group | xset.group.RData | rdata.xcms.group | RData file | ++------------------------+------------------+--------------------+------------+ **Downstream tools** @@ -158,14 +156,11 @@ |xcms.summary | xset.retcor.RData| rdata.xcms.fillpeaks | +---------------------------+------------------+-----------------------+ -The output file **xset.fillpeaks** is a RData file. You can continue your analysis using it in **CAMERA.annotate** or **xcms.summary** tool as a following step of your workflow. - - **General schema of the metabolomic workflow** .. image:: xcms_fillpeaks_workflow.png - +--------------------------------------------------- ----------- Input files @@ -195,26 +190,7 @@ | "MSW" is used for peaklists without retention-time information like those from direct-infusion spectra. - -Get a Peak List ---------------- - -If 'true', the module generates two additional files corresponding to the peak list: -- the variable metadata file (corresponding to information about extracted ions such as mass or retention time) -- the data matrix (corresponding to related intensities) - -**decimal places for [mass or retention time] values in identifiers** - - | Ions' identifiers are constructed as MxxxTyyy where 'xxx' is the ion median mass and 'yyy' the ion median retention time. - | Two parameters are used to adjust the number of decimal places wanted in identifiers for mass and retention time respectively. - | Theses parameters do not affect decimal places in columns other than the identifier one. - -**Reported intensity values** - - | This parameter determines which values should be reported as intensities in the dataMatrix table; it correspond to xcms 'intval' parameter: - | - into: integrated area of original (raw) peak - | - maxo: maximum intensity of original (raw) peak - | - intb: baseline corrected integrated peak area (only available if peak detection was done by ‘findPeaks.centWave’) +@HELP_GET_PEAK_LIST@ ------------ Output files @@ -224,19 +200,7 @@ | Rdata file that will be used in the **CAMERA.annotate** or **xcms.summary** step of the workflow. -xset.variableMetadata.tsv : tabular format - - | Table containing information about ions; can be used as one input of **Quality_Metrics** or **Generic_filter* modules. - -xset.dataMatrix.tsv : tabular format - - | Table containing ions' intensities; can be used as one input of **Quality_Metrics** or **Generic_filter* modules. - ------- - -.. class:: infomark - -The output file is a xset.fillPeaks.RData file. You can continue your analysis using it in **CAMERA.annotate** or **xcms.summary** tool. +@HELP_GET_PEAK_LIST_OUTPUTS@ --------------------------------------------------- @@ -253,14 +217,7 @@ Parameters ---------- - | method -> **chrom** - | Get a Peak List -> **false** - - -Output files ------------- - - | **xset.fillPeaks.RData: RData file** + | **method**: chrom ---------------------------------------------------
