Mercurial > repos > galaxyp > openms_isobaricanalyzer
comparison IsobaricAnalyzer.xml @ 1:125774c3e8aa draft
planemo upload for repository https://github.com/galaxyproteomics/tools-galaxyp/tree/master/tools/openms commit 9a14ed1f2d3c9abdfb080251b3419dd9e0c52a14
author | galaxyp |
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date | Wed, 09 Aug 2017 09:05:28 -0400 |
parents | 916f41a35640 |
children | edb972ad2c81 |
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0:916f41a35640 | 1:125774c3e8aa |
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1 <?xml version='1.0' encoding='UTF-8'?> | 1 <?xml version='1.0' encoding='UTF-8'?> |
2 <!--This is a configuration file for the integration of a tools into Galaxy (https://galaxyproject.org/). This file was automatically generated using CTD2Galaxy.--> | 2 <!--This is a configuration file for the integration of a tools into Galaxy (https://galaxyproject.org/). This file was automatically generated using CTD2Galaxy.--> |
3 <!--Proposed Tool Section: [Quantitation]--> | 3 <!--Proposed Tool Section: [Quantitation]--> |
4 <tool id="IsobaricAnalyzer" name="IsobaricAnalyzer" version="2.1.0"> | 4 <tool id="IsobaricAnalyzer" name="IsobaricAnalyzer" version="2.2.0"> |
5 <description>Calculates isobaric quantitative values for peptides</description> | 5 <description>Calculates isobaric quantitative values for peptides</description> |
6 <macros> | 6 <macros> |
7 <token name="@EXECUTABLE@">IsobaricAnalyzer</token> | 7 <token name="@EXECUTABLE@">IsobaricAnalyzer</token> |
8 <import>macros.xml</import> | 8 <import>macros.xml</import> |
9 </macros> | 9 </macros> |
11 <expand macro="stdio"/> | 11 <expand macro="stdio"/> |
12 <expand macro="requirements"/> | 12 <expand macro="requirements"/> |
13 <command>IsobaricAnalyzer | 13 <command>IsobaricAnalyzer |
14 | 14 |
15 #if $param_type: | 15 #if $param_type: |
16 -type $param_type | 16 -type |
17 #if " " in str($param_type): | |
18 "$param_type" | |
19 #else | |
20 $param_type | |
21 #end if | |
17 #end if | 22 #end if |
18 #if $param_in: | 23 #if $param_in: |
19 -in $param_in | 24 -in $param_in |
20 #end if | 25 #end if |
21 #if $param_out: | 26 #if $param_out: |
23 #end if | 28 #end if |
24 #if $param_id_pool: | 29 #if $param_id_pool: |
25 -id_pool "$param_id_pool" | 30 -id_pool "$param_id_pool" |
26 #end if | 31 #end if |
27 #if $param_extraction_select_activation: | 32 #if $param_extraction_select_activation: |
28 -extraction:select_activation $param_extraction_select_activation | 33 -extraction:select_activation |
34 #if " " in str($param_extraction_select_activation): | |
35 "$param_extraction_select_activation" | |
36 #else | |
37 $param_extraction_select_activation | |
38 #end if | |
29 #end if | 39 #end if |
30 #if $param_extraction_reporter_mass_shift: | 40 #if $param_extraction_reporter_mass_shift: |
31 -extraction:reporter_mass_shift $param_extraction_reporter_mass_shift | 41 -extraction:reporter_mass_shift $param_extraction_reporter_mass_shift |
32 #end if | 42 #end if |
33 #if $param_extraction_min_precursor_intensity: | 43 #if $param_extraction_min_precursor_intensity: |
34 -extraction:min_precursor_intensity $param_extraction_min_precursor_intensity | 44 -extraction:min_precursor_intensity $param_extraction_min_precursor_intensity |
35 #end if | 45 #end if |
36 #if $param_extraction_keep_unannotated_precursor: | 46 #if $param_extraction_keep_unannotated_precursor: |
37 -extraction:keep_unannotated_precursor $param_extraction_keep_unannotated_precursor | 47 -extraction:keep_unannotated_precursor |
48 #if " " in str($param_extraction_keep_unannotated_precursor): | |
49 "$param_extraction_keep_unannotated_precursor" | |
50 #else | |
51 $param_extraction_keep_unannotated_precursor | |
52 #end if | |
38 #end if | 53 #end if |
39 #if $param_extraction_min_reporter_intensity: | 54 #if $param_extraction_min_reporter_intensity: |
40 -extraction:min_reporter_intensity $param_extraction_min_reporter_intensity | 55 -extraction:min_reporter_intensity $param_extraction_min_reporter_intensity |
41 #end if | 56 #end if |
42 #if $param_extraction_discard_low_intensity_quantifications: | 57 #if $param_extraction_discard_low_intensity_quantifications: |
108 $token.param_itraq8plex_correction_matrix | 123 $token.param_itraq8plex_correction_matrix |
109 #end if | 124 #end if |
110 #end for | 125 #end for |
111 #end if | 126 #end if |
112 #if $param_quantification_isotope_correction: | 127 #if $param_quantification_isotope_correction: |
113 -quantification:isotope_correction $param_quantification_isotope_correction | 128 -quantification:isotope_correction |
129 #if " " in str($param_quantification_isotope_correction): | |
130 "$param_quantification_isotope_correction" | |
131 #else | |
132 $param_quantification_isotope_correction | |
133 #end if | |
114 #end if | 134 #end if |
115 #if $param_quantification_normalization: | 135 #if $param_quantification_normalization: |
116 -quantification:normalization | 136 -quantification:normalization |
117 #end if | 137 #end if |
118 #if $param_tmt10plex_channel_126_description: | 138 #if $param_tmt10plex_channel_126_description: |
144 #end if | 164 #end if |
145 #if $param_tmt10plex_channel_131_description: | 165 #if $param_tmt10plex_channel_131_description: |
146 -tmt10plex:channel_131_description "$param_tmt10plex_channel_131_description" | 166 -tmt10plex:channel_131_description "$param_tmt10plex_channel_131_description" |
147 #end if | 167 #end if |
148 #if $param_tmt10plex_reference_channel: | 168 #if $param_tmt10plex_reference_channel: |
149 -tmt10plex:reference_channel $param_tmt10plex_reference_channel | 169 -tmt10plex:reference_channel |
170 #if " " in str($param_tmt10plex_reference_channel): | |
171 "$param_tmt10plex_reference_channel" | |
172 #else | |
173 $param_tmt10plex_reference_channel | |
174 #end if | |
150 #end if | 175 #end if |
151 | 176 |
152 #if $rep_param_tmt10plex_correction_matrix: | 177 #if $rep_param_tmt10plex_correction_matrix: |
153 -tmt10plex:correction_matrix | 178 -tmt10plex:correction_matrix |
154 #for token in $rep_param_tmt10plex_correction_matrix: | 179 #for token in $rep_param_tmt10plex_correction_matrix: |
197 #end if | 222 #end if |
198 #if $adv_opts.param_extraction_precursor_isotope_deviation: | 223 #if $adv_opts.param_extraction_precursor_isotope_deviation: |
199 -extraction:precursor_isotope_deviation $adv_opts.param_extraction_precursor_isotope_deviation | 224 -extraction:precursor_isotope_deviation $adv_opts.param_extraction_precursor_isotope_deviation |
200 #end if | 225 #end if |
201 #if $adv_opts.param_extraction_purity_interpolation: | 226 #if $adv_opts.param_extraction_purity_interpolation: |
202 -extraction:purity_interpolation $adv_opts.param_extraction_purity_interpolation | 227 -extraction:purity_interpolation |
228 #if " " in str($adv_opts.param_extraction_purity_interpolation): | |
229 "$adv_opts.param_extraction_purity_interpolation" | |
230 #else | |
231 $adv_opts.param_extraction_purity_interpolation | |
232 #end if | |
203 #end if | 233 #end if |
204 #end if | 234 #end if |
205 </command> | 235 </command> |
206 <inputs> | 236 <inputs> |
207 <param name="param_type" display="radio" type="select" optional="False" value="itraq4plex" label="Isobaric Quantitation method used in the experiment" help="(-type) "> | 237 <param name="param_type" display="radio" type="select" optional="False" value="itraq4plex" label="Isobaric Quantitation method used in the experiment" help="(-type) "> |
209 <option value="itraq8plex">itraq8plex</option> | 239 <option value="itraq8plex">itraq8plex</option> |
210 <option value="tmt10plex">tmt10plex</option> | 240 <option value="tmt10plex">tmt10plex</option> |
211 <option value="tmt6plex">tmt6plex</option> | 241 <option value="tmt6plex">tmt6plex</option> |
212 </param> | 242 </param> |
213 <param name="param_in" type="data" format="mzml" optional="False" label="input raw/picked data file" help="(-in) "/> | 243 <param name="param_in" type="data" format="mzml" optional="False" label="input raw/picked data file" help="(-in) "/> |
214 <param name="param_id_pool" type="text" size="30" label="ID pool file to DocumentID's for all generated output files" help="(-id_pool) Disabled by default. (Set to 'main' to use /home/ubuntu/miniconda3/envs/py2test/share/OpenMS/IDPool/IDPool.txt)"> | 244 <param name="param_id_pool" type="text" size="30" label="ID pool file to DocumentID's for all generated output files" help="(-id_pool) Disabled by default. (Set to 'main' to use /home/ubuntu/mount/miniconda3/envs/openms2.2/share/OpenMS/IDPool/IDPool.txt)"> |
215 <sanitizer> | 245 <sanitizer> |
216 <valid initial="string.printable"> | 246 <valid initial="string.printable"> |
217 <remove value="'"/> | 247 <remove value="'"/> |
218 <remove value="""/> | 248 <remove value="""/> |
219 </valid> | 249 </valid> |
232 <option value="Low-energy collision-induced dissociation">Low-energy collision-induced dissociation</option> | 262 <option value="Low-energy collision-induced dissociation">Low-energy collision-induced dissociation</option> |
233 <option value="Photodissociation">Photodissociation</option> | 263 <option value="Photodissociation">Photodissociation</option> |
234 <option value="Electron transfer dissociation">Electron transfer dissociation</option> | 264 <option value="Electron transfer dissociation">Electron transfer dissociation</option> |
235 <option value=""></option> | 265 <option value=""></option> |
236 </param> | 266 </param> |
237 <param name="param_extraction_reporter_mass_shift" type="float" min="1e-08" max="0.5" optional="True" value="0.1" label="Allowed shift (left to right) in Da from the expected position" help="(-reporter_mass_shift) "/> | 267 <param name="param_extraction_reporter_mass_shift" type="float" min="0.0001" max="0.5" optional="True" value="0.002" label="Allowed shift (left to right) in Th from the expected position" help="(-reporter_mass_shift) "/> |
238 <param name="param_extraction_min_precursor_intensity" type="float" min="0.0" optional="True" value="1.0" label="Minimum intensity of the precursor to be extracted" help="(-min_precursor_intensity) MS/MS scans having a precursor with a lower intensity will not be considered for quantitation"/> | 268 <param name="param_extraction_min_precursor_intensity" type="float" min="0.0" optional="True" value="1.0" label="Minimum intensity of the precursor to be extracted" help="(-min_precursor_intensity) MS/MS scans having a precursor with a lower intensity will not be considered for quantitation"/> |
239 <param name="param_extraction_keep_unannotated_precursor" display="radio" type="select" optional="False" value="true" label="Flag if precursor with missing intensity value or missing precursor spectrum should be included or not" help="(-keep_unannotated_precursor) "> | 269 <param name="param_extraction_keep_unannotated_precursor" display="radio" type="select" optional="False" value="true" label="Flag if precursor with missing intensity value or missing precursor spectrum should be included or not" help="(-keep_unannotated_precursor) "> |
240 <option value="true" selected="true">true</option> | 270 <option value="true" selected="true">true</option> |
241 <option value="false">false</option> | 271 <option value="false">false</option> |
242 </param> | 272 </param> |