diff mqppep_preproc.xml @ 16:d9906288cc6a draft

"planemo upload for repository https://github.com/galaxyproteomics/tools-galaxyp/tree/master/tools/mqppep commit 7127d1511d45a8b22d4f50eee6db24d844371227"
author eschen42
date Tue, 05 Apr 2022 01:47:37 +0000
parents 28a126da9b28
children 43f1fd0ff86b
line wrap: on
line diff
--- a/mqppep_preproc.xml	Sat Mar 26 02:26:38 2022 +0000
+++ b/mqppep_preproc.xml	Tue Apr 05 01:47:37 2022 +0000
@@ -1,4 +1,10 @@
-<tool id="mqppep_preproc" name="MaxQuant Phosphopeptide Preprocessing" version="@TOOL_VERSION@+galaxy@VERSION_SUFFIX@" python_template_version="3.5">
+<tool
+  id="mqppep_preproc"
+  name="MaxQuant Phosphopeptide Preprocessing"
+  version="@TOOL_VERSION@+galaxy@VERSION_SUFFIX@"
+  python_template_version="3.5"
+  profile="21.05"
+  >
     <description>
         Transform the output of MaxQuant for phosphoproteome-enriched samples to prepare it for statistical anlaysis.
     </description>
@@ -10,7 +16,7 @@
       (
         echo '--- localization-filter step:'
       ) && (
-        \$CONDA_PREFIX/bin/Rscript '$__tool_directory__/MaxQuantProcessingScript.R'
+        Rscript '$__tool_directory__/MaxQuantProcessingScript.R'
         -i '$phosphoSites'
         #if $pst_py_selector == "y"
             --enriched Y
@@ -34,7 +40,7 @@
       ) && (
         echo '--- kinase-mapping step:'
       ) && (
-        \$CONDA_PREFIX/bin/perl '$__tool_directory__/PhosphoPeptide_Upstream_Kinase_Mapping.pl'
+        perl '$__tool_directory__/PhosphoPeptide_Upstream_Kinase_Mapping.pl'
         -i '$phosphoPepIntensities'
         -f '$protein_fasta'
         -n '$networkin'
@@ -56,7 +62,7 @@
       ) && (
         echo '--- merge-and-filter step:'
       ) && (
-        \$CONDA_PREFIX/bin/python '$__tool_directory__/mqppep_mrgfltr.py'
+        python '$__tool_directory__/mqppep_mrgfltr.py'
         --phosphopeptides='$mapped_phophopeptides'
         --ppep_mapping_db='$mqppep_output_sqlite'
         --species='$species'
@@ -368,7 +374,8 @@
 
        *To generate this file:*
 
-       **(1)** Download the "precomputed data for all available kinase predictors against ENSEMBL" [available at the NetworkKIN predictions link on the downloads page at `https://networkin.info/download.shtml <https://networkin.info/download.shtml>`_] (N.B.: "Commercial users are requested to contact the authors before using the data on this website");
+       **(1)** Download the "precomputed data for all available kinase predictors against ENSEMBL"
+       (Available at the NetworkKIN predictions link on the downloads page at https://web.archive.org/web/20200208000403/http://networkin.info/download/networkin_human_predictions_3.1.tsv.xz;  N.B.: "Commercial users are requested to contact the authors before using the data on the networkin.info website");
 
        **(2)** Decompress the .tsv.xz with file with "unxz" (from XZ Utils `https://tukaani.org/xz/ <https://tukaani.org/xz/>`_);