Mercurial > repos > pieterlukasse > prims_metabolomics
diff msclust.xml @ 30:60b53f2aa48a
Small fixes, added microminutes support to MsClust, removed TIC or MsClust output
author | pieter.lukasse@wur.nl |
---|---|
date | Sat, 30 Aug 2014 16:14:18 +0200 |
parents | 0d534bce8e84 |
children | 31e6e2242d33 |
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--- a/msclust.xml Fri May 09 17:11:11 2014 +0200 +++ b/msclust.xml Sat Aug 30 16:14:18 2014 +0200 @@ -64,9 +64,7 @@ </command> <inputs> - <!-- <param name="rankingWeightConfig" type="text" area="true" size="11x70" label="NB - TEST VERSION" -value="VERSION BEING TESTED AT THIS MOMENT...NOT READY FOR USE..."/> - --> + <param name="inputPeaks" type="data" format="txt" label="Ion-wise aligned data (e.g. MetAlign output data)" /> <param name="dataType" type="select" size="30" label="Data type"> <option value="gcms" selected="true">GC-MS</option> @@ -222,6 +220,20 @@ ----- +**Input** + +The input file should contain the following columns (in this order), followed by the sample intensity columns (one column with the +intensity value for each sample): + +*ScanNR +*Ret(umin) +*Mass(uD) +*(Optional)retentionMean +*(only required if retentionMean is present)retentionSD +*N sample intensity columns... + +----- + **Output** This tools returns a number of ouptut files and a small report.