Mercurial > repos > galaxyp > openms_falsediscoveryrate
comparison FalseDiscoveryRate.xml @ 16:4138acdeedfb draft default tip
planemo upload for repository https://github.com/galaxyproteomics/tools-galaxyp/tree/master/tools/openms commit 5c080b1e2b99f1c88f4557e9fec8c45c9d23b906
author | galaxyp |
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date | Fri, 14 Jun 2024 21:39:03 +0000 |
parents | 6ccbf9a2072c |
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15:6ccbf9a2072c | 16:4138acdeedfb |
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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 CTDConverter.--> | 1 <!--This is a configuration file for the integration of a tools into Galaxy (https://galaxyproject.org/). This file was automatically generated using CTDConverter.--> |
3 <!--Proposed Tool Section: [ID Processing]--> | 2 <!--Proposed Tool Section: [Identification Processing]--> |
4 <tool id="FalseDiscoveryRate" name="FalseDiscoveryRate" version="@TOOL_VERSION@+galaxy@VERSION_SUFFIX@" profile="21.05"> | 3 <tool id="FalseDiscoveryRate" name="FalseDiscoveryRate" version="@TOOL_VERSION@+galaxy@VERSION_SUFFIX@" profile="21.05"> |
5 <description>Estimates the false discovery rate on peptide and protein level using decoy searches.</description> | 4 <description>Estimates the false discovery rate on peptide and protein level using decoy searches</description> |
6 <macros> | 5 <macros> |
7 <token name="@EXECUTABLE@">FalseDiscoveryRate</token> | 6 <token name="@EXECUTABLE@">FalseDiscoveryRate</token> |
8 <import>macros.xml</import> | 7 <import>macros.xml</import> |
9 </macros> | 8 </macros> |
10 <expand macro="requirements"/> | 9 <expand macro="requirements"/> |
13 @EXT_FOO@ | 12 @EXT_FOO@ |
14 #import re | 13 #import re |
15 | 14 |
16 ## Preprocessing | 15 ## Preprocessing |
17 mkdir in && | 16 mkdir in && |
18 ln -s '$in' 'in/${re.sub("[^\w\-_]", "_", $in.element_identifier)}.$gxy2omsext($in.ext)' && | 17 cp '$in' 'in/${re.sub("[^\w\-_]", "_", $in.element_identifier)}.$gxy2omsext($in.ext)' && |
19 mkdir out && | 18 mkdir out && |
20 | 19 |
21 ## Main program call | 20 ## Main program call |
22 | 21 |
23 set -o pipefail && | 22 set -o pipefail && |
37 <configfiles> | 36 <configfiles> |
38 <inputs name="args_json" data_style="paths"/> | 37 <inputs name="args_json" data_style="paths"/> |
39 <configfile name="hardcoded_json"><![CDATA[{"log": "log.txt", "threads": "\${GALAXY_SLOTS:-1}", "no_progress": true}]]></configfile> | 38 <configfile name="hardcoded_json"><![CDATA[{"log": "log.txt", "threads": "\${GALAXY_SLOTS:-1}", "no_progress": true}]]></configfile> |
40 </configfiles> | 39 </configfiles> |
41 <inputs> | 40 <inputs> |
42 <param argument="-in" type="data" format="idxml" optional="false" label="Identifications from searching a target-decoy database" help=" select idxml data sets(s)"/> | 41 <param argument="-in" type="data" format="idxml" label="Identifications from searching a target-decoy database" help=" select idxml data sets(s)"/> |
43 <param argument="-PSM" type="boolean" truevalue="true" falsevalue="false" checked="true" label="Perform FDR calculation on PSM level" help=""/> | 42 <param argument="-PSM" type="boolean" truevalue="true" falsevalue="false" checked="true" label="Perform FDR calculation on PSM level" help=""/> |
43 <param argument="-peptide" type="boolean" truevalue="true" falsevalue="false" checked="false" label="Perform FDR calculation on peptide level and annotates it as meta value" help="(Note: if set, also calculates FDR/q-value on PSM level.)"/> | |
44 <param argument="-protein" type="boolean" truevalue="true" falsevalue="false" checked="true" label="Perform FDR calculation on protein level" help=""/> | 44 <param argument="-protein" type="boolean" truevalue="true" falsevalue="false" checked="true" label="Perform FDR calculation on protein level" help=""/> |
45 <section name="FDR" title="FDR control" help="" expanded="false"> | 45 <section name="FDR" title="FDR control" help="" expanded="false"> |
46 <param name="PSM" argument="-FDR:PSM" type="float" optional="true" min="0.0" max="1.0" value="1.0" label="Filter PSMs based on q-value" help="(e.g., 0.05 = 5% FDR, disabled for 1)"/> | 46 <param name="PSM" argument="-FDR:PSM" type="float" min="0.0" max="1.0" value="1.0" label="Filter PSMs based on q-value" help="(e.g., 0.05 = 5% FDR, disabled for 1)"/> |
47 <param name="protein" argument="-FDR:protein" type="float" optional="true" min="0.0" max="1.0" value="1.0" label="Filter proteins based on q-value" help="(e.g., 0.05 = 5% FDR, disabled for 1)"/> | 47 <param name="protein" argument="-FDR:protein" type="float" min="0.0" max="1.0" value="1.0" label="Filter proteins based on q-value" help="(e.g., 0.05 = 5% FDR, disabled for 1)"/> |
48 <section name="cleanup" title="Cleanup references after FDR control" help="" expanded="false"> | 48 <section name="cleanup" title="Cleanup references after FDR control" help="" expanded="false"> |
49 <param name="remove_proteins_without_psms" argument="-FDR:cleanup:remove_proteins_without_psms" type="boolean" truevalue="true" falsevalue="false" checked="true" label="Remove proteins without PSMs (due to being decoy or below PSM FDR threshold)" help=""/> | 49 <param name="remove_proteins_without_psms" argument="-FDR:cleanup:remove_proteins_without_psms" type="boolean" truevalue="true" falsevalue="false" checked="true" label="Remove proteins without PSMs (due to being decoy or below PSM FDR threshold)" help=""/> |
50 <param name="remove_psms_without_proteins" argument="-FDR:cleanup:remove_psms_without_proteins" type="boolean" truevalue="true" falsevalue="false" checked="true" label="Remove PSMs without proteins (due to being decoy or below protein FDR threshold)" help=""/> | 50 <param name="remove_psms_without_proteins" argument="-FDR:cleanup:remove_psms_without_proteins" type="boolean" truevalue="true" falsevalue="false" checked="true" label="Remove PSMs without proteins (due to being decoy or below protein FDR threshold)" help=""/> |
51 <param name="remove_spectra_without_psms" argument="-FDR:cleanup:remove_spectra_without_psms" type="boolean" truevalue="true" falsevalue="false" checked="true" label="Remove spectra without PSMs (due to being decoy or below protein FDR threshold)" help="Caution: if remove_psms_without_proteins is false, protein level filtering does not propagate"/> | 51 <param name="remove_spectra_without_psms" argument="-FDR:cleanup:remove_spectra_without_psms" type="boolean" truevalue="true" falsevalue="false" checked="true" label="Remove spectra without PSMs (due to being decoy or below protein FDR threshold)" help="Caution: if remove_psms_without_proteins is false, protein level filtering does not propagate"/> |
52 </section> | 52 </section> |
60 <param name="add_decoy_proteins" argument="-algorithm:add_decoy_proteins" type="boolean" truevalue="true" falsevalue="false" checked="false" label="If 'true' decoy proteins will be written to output file, too" help="The q-value is set to the closest target score"/> | 60 <param name="add_decoy_proteins" argument="-algorithm:add_decoy_proteins" type="boolean" truevalue="true" falsevalue="false" checked="false" label="If 'true' decoy proteins will be written to output file, too" help="The q-value is set to the closest target score"/> |
61 <param name="conservative" argument="-algorithm:conservative" type="boolean" truevalue="true" falsevalue="false" checked="true" label="If 'true' (D+1)/T instead of (D+1)/(T+D) is used as a formula" help=""/> | 61 <param name="conservative" argument="-algorithm:conservative" type="boolean" truevalue="true" falsevalue="false" checked="true" label="If 'true' (D+1)/T instead of (D+1)/(T+D) is used as a formula" help=""/> |
62 </section> | 62 </section> |
63 <expand macro="adv_opts_macro"> | 63 <expand macro="adv_opts_macro"> |
64 <param argument="-force" type="boolean" truevalue="true" falsevalue="false" checked="false" label="Overrides tool-specific checks" help=""/> | 64 <param argument="-force" type="boolean" truevalue="true" falsevalue="false" checked="false" label="Overrides tool-specific checks" help=""/> |
65 <param argument="-test" type="hidden" optional="true" value="False" label="Enables the test mode (needed for internal use only)" help=""> | 65 <param argument="-test" type="hidden" value="False" label="Enables the test mode (needed for internal use only)" help="" optional="true"> |
66 <expand macro="list_string_san" name="test"/> | 66 <expand macro="list_string_san" name="test"/> |
67 </param> | 67 </param> |
68 </expand> | 68 </expand> |
69 <param name="OPTIONAL_OUTPUTS" type="select" optional="true" multiple="true" label="Optional outputs"> | 69 <param name="OPTIONAL_OUTPUTS" type="select" optional="true" multiple="true" label="Optional outputs"> |
70 <option value="ctd_out_FLAG">Output used ctd (ini) configuration file</option> | 70 <option value="ctd_out_FLAG">Output used ctd (ini) configuration file</option> |
74 <data name="out" label="${tool.name} on ${on_string}: out" format="idxml"/> | 74 <data name="out" label="${tool.name} on ${on_string}: out" format="idxml"/> |
75 <data name="ctd_out" format="xml" label="${tool.name} on ${on_string}: ctd"> | 75 <data name="ctd_out" format="xml" label="${tool.name} on ${on_string}: ctd"> |
76 <filter>OPTIONAL_OUTPUTS is not None and "ctd_out_FLAG" in OPTIONAL_OUTPUTS</filter> | 76 <filter>OPTIONAL_OUTPUTS is not None and "ctd_out_FLAG" in OPTIONAL_OUTPUTS</filter> |
77 </data> | 77 </data> |
78 </outputs> | 78 </outputs> |
79 <tests><!-- TOPP_FalseDiscoveryRate_1 --> | 79 <tests> |
80 <!-- TOPP_FalseDiscoveryRate_1 --> | |
80 <test expect_num_outputs="2"> | 81 <test expect_num_outputs="2"> |
81 <section name="adv_opts"> | 82 <section name="adv_opts"> |
82 <param name="force" value="false"/> | 83 <param name="force" value="false"/> |
83 <param name="test" value="true"/> | 84 <param name="test" value="true"/> |
84 </section> | 85 </section> |
85 <param name="in" value="FalseDiscoveryRate_OMSSA.idXML"/> | 86 <param name="in" value="FalseDiscoveryRate_OMSSA.idXML"/> |
86 <output name="out" file="FalseDiscoveryRate_output_1.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> | 87 <output name="out" value="FalseDiscoveryRate_output_1.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> |
87 <param name="PSM" value="true"/> | 88 <param name="PSM" value="true"/> |
88 <param name="protein" value="false"/> | 89 <param name="peptide" value="false"/> |
89 <section name="FDR"> | 90 <param name="protein" value="false"/> |
90 <param name="PSM" value="1.0"/> | 91 <section name="FDR"> |
91 <param name="protein" value="1.0"/> | 92 <param name="PSM" value="1.0"/> |
92 <section name="cleanup"> | 93 <param name="protein" value="1.0"/> |
93 <param name="remove_proteins_without_psms" value="true"/> | 94 <section name="cleanup"> |
94 <param name="remove_psms_without_proteins" value="true"/> | 95 <param name="remove_proteins_without_psms" value="true"/> |
95 <param name="remove_spectra_without_psms" value="true"/> | 96 <param name="remove_psms_without_proteins" value="true"/> |
96 </section> | 97 <param name="remove_spectra_without_psms" value="true"/> |
97 </section> | 98 </section> |
98 <section name="algorithm"> | 99 </section> |
99 <param name="no_qvalues" value="false"/> | 100 <section name="algorithm"> |
100 <param name="use_all_hits" value="false"/> | 101 <param name="no_qvalues" value="false"/> |
101 <param name="split_charge_variants" value="false"/> | 102 <param name="use_all_hits" value="false"/> |
102 <param name="treat_runs_separately" value="false"/> | 103 <param name="split_charge_variants" value="false"/> |
103 <param name="add_decoy_peptides" value="false"/> | 104 <param name="treat_runs_separately" value="false"/> |
104 <param name="add_decoy_proteins" value="false"/> | 105 <param name="add_decoy_peptides" value="false"/> |
105 <param name="conservative" value="true"/> | 106 <param name="add_decoy_proteins" value="false"/> |
106 </section> | 107 <param name="conservative" value="true"/> |
107 <param name="OPTIONAL_OUTPUTS" value="ctd_out_FLAG"/> | 108 </section> |
108 <output name="ctd_out" ftype="xml"> | 109 <param name="OPTIONAL_OUTPUTS" value="ctd_out_FLAG"/> |
109 <assert_contents> | 110 <output name="ctd_out" ftype="xml"> |
110 <is_valid_xml/> | 111 <assert_contents> |
111 </assert_contents> | 112 <is_valid_xml/> |
112 </output> | 113 </assert_contents> |
114 </output> | |
115 <assert_stdout> | |
116 <has_text_matching expression="@EXECUTABLE@ took .* \(wall\), .* \(CPU\), .* \(system\), .* \(user\)(; Peak Memory Usage: 32 MB)?."/> | |
117 </assert_stdout> | |
113 </test> | 118 </test> |
114 <!-- TOPP_FalseDiscoveryRate_2 --> | 119 <!-- TOPP_FalseDiscoveryRate_2 --> |
115 <test expect_num_outputs="2"> | 120 <test expect_num_outputs="2"> |
116 <section name="adv_opts"> | 121 <section name="adv_opts"> |
117 <param name="force" value="false"/> | 122 <param name="force" value="false"/> |
118 <param name="test" value="true"/> | 123 <param name="test" value="true"/> |
119 </section> | 124 </section> |
120 <param name="in" value="FalseDiscoveryRate_OMSSA.idXML"/> | 125 <param name="in" value="FalseDiscoveryRate_OMSSA.idXML"/> |
121 <output name="out" file="FalseDiscoveryRate_output_2.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> | 126 <output name="out" value="FalseDiscoveryRate_output_2.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> |
122 <param name="PSM" value="true"/> | 127 <param name="PSM" value="true"/> |
128 <param name="peptide" value="false"/> | |
123 <param name="protein" value="false"/> | 129 <param name="protein" value="false"/> |
124 <section name="FDR"> | 130 <section name="FDR"> |
125 <param name="PSM" value="1.0"/> | 131 <param name="PSM" value="1.0"/> |
126 <param name="protein" value="1.0"/> | 132 <param name="protein" value="1.0"/> |
127 <section name="cleanup"> | 133 <section name="cleanup"> |
143 <output name="ctd_out" ftype="xml"> | 149 <output name="ctd_out" ftype="xml"> |
144 <assert_contents> | 150 <assert_contents> |
145 <is_valid_xml/> | 151 <is_valid_xml/> |
146 </assert_contents> | 152 </assert_contents> |
147 </output> | 153 </output> |
154 <assert_stdout> | |
155 <has_text_matching expression="@EXECUTABLE@ took .* \(wall\), .* \(CPU\), .* \(system\), .* \(user\)(; Peak Memory Usage: 32 MB)?."/> | |
156 </assert_stdout> | |
148 </test> | 157 </test> |
149 <!-- TOPP_FalseDiscoveryRate_3 --> | 158 <!-- TOPP_FalseDiscoveryRate_3 --> |
150 <test expect_num_outputs="2"> | 159 <test expect_num_outputs="2"> |
151 <section name="adv_opts"> | 160 <section name="adv_opts"> |
152 <param name="force" value="false"/> | 161 <param name="force" value="false"/> |
153 <param name="test" value="true"/> | 162 <param name="test" value="true"/> |
154 </section> | 163 </section> |
155 <param name="in" value="FalseDiscoveryRate_OMSSA.idXML"/> | 164 <param name="in" value="FalseDiscoveryRate_OMSSA.idXML"/> |
156 <output name="out" file="FalseDiscoveryRate_output_3.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> | 165 <output name="out" value="FalseDiscoveryRate_output_3.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> |
157 <param name="PSM" value="true"/> | 166 <param name="PSM" value="true"/> |
167 <param name="peptide" value="false"/> | |
158 <param name="protein" value="false"/> | 168 <param name="protein" value="false"/> |
159 <section name="FDR"> | 169 <section name="FDR"> |
160 <param name="PSM" value="1.0"/> | 170 <param name="PSM" value="1.0"/> |
161 <param name="protein" value="1.0"/> | 171 <param name="protein" value="1.0"/> |
162 <section name="cleanup"> | 172 <section name="cleanup"> |
178 <output name="ctd_out" ftype="xml"> | 188 <output name="ctd_out" ftype="xml"> |
179 <assert_contents> | 189 <assert_contents> |
180 <is_valid_xml/> | 190 <is_valid_xml/> |
181 </assert_contents> | 191 </assert_contents> |
182 </output> | 192 </output> |
193 <assert_stdout> | |
194 <has_text_matching expression="@EXECUTABLE@ took .* \(wall\), .* \(CPU\), .* \(system\), .* \(user\)(; Peak Memory Usage: 32 MB)?."/> | |
195 </assert_stdout> | |
183 </test> | 196 </test> |
184 <!-- TOPP_FalseDiscoveryRate_4 --> | 197 <!-- TOPP_FalseDiscoveryRate_4 --> |
185 <test expect_num_outputs="2"> | 198 <test expect_num_outputs="2"> |
186 <section name="adv_opts"> | 199 <section name="adv_opts"> |
187 <param name="force" value="false"/> | 200 <param name="force" value="false"/> |
188 <param name="test" value="true"/> | 201 <param name="test" value="true"/> |
189 </section> | 202 </section> |
190 <param name="in" value="FalseDiscoveryRate_OMSSA_4.idXML"/> | 203 <param name="in" value="FalseDiscoveryRate_OMSSA_4.idXML"/> |
191 <output name="out" file="FalseDiscoveryRate_output_4.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> | 204 <output name="out" value="FalseDiscoveryRate_output_4.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> |
192 <param name="PSM" value="true"/> | 205 <param name="PSM" value="true"/> |
206 <param name="peptide" value="false"/> | |
193 <param name="protein" value="false"/> | 207 <param name="protein" value="false"/> |
194 <section name="FDR"> | 208 <section name="FDR"> |
195 <param name="PSM" value="1.0"/> | 209 <param name="PSM" value="1.0"/> |
196 <param name="protein" value="1.0"/> | 210 <param name="protein" value="1.0"/> |
197 <section name="cleanup"> | 211 <section name="cleanup"> |
213 <output name="ctd_out" ftype="xml"> | 227 <output name="ctd_out" ftype="xml"> |
214 <assert_contents> | 228 <assert_contents> |
215 <is_valid_xml/> | 229 <is_valid_xml/> |
216 </assert_contents> | 230 </assert_contents> |
217 </output> | 231 </output> |
232 <assert_stdout> | |
233 <has_text_matching expression="@EXECUTABLE@ took .* \(wall\), .* \(CPU\), .* \(system\), .* \(user\)(; Peak Memory Usage: 32 MB)?."/> | |
234 </assert_stdout> | |
218 </test> | 235 </test> |
219 <!-- TOPP_FalseDiscoveryRate_5 --> | 236 <!-- TOPP_FalseDiscoveryRate_5 --> |
220 <test expect_num_outputs="2"> | 237 <test expect_num_outputs="2"> |
221 <section name="adv_opts"> | 238 <section name="adv_opts"> |
222 <param name="force" value="true"/> | 239 <param name="force" value="true"/> |
223 <param name="test" value="true"/> | 240 <param name="test" value="true"/> |
224 </section> | 241 </section> |
225 <param name="in" value="FalseDiscoveryRate_5_input.idXML"/> | 242 <param name="in" value="FalseDiscoveryRate_5_input.idXML"/> |
226 <output name="out" file="FalseDiscoveryRate_5_output.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> | 243 <output name="out" value="FalseDiscoveryRate_5_output.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> |
227 <param name="PSM" value="false"/> | 244 <param name="PSM" value="false"/> |
245 <param name="peptide" value="false"/> | |
228 <param name="protein" value="true"/> | 246 <param name="protein" value="true"/> |
229 <section name="FDR"> | 247 <section name="FDR"> |
230 <param name="PSM" value="1.0"/> | 248 <param name="PSM" value="1.0"/> |
231 <param name="protein" value="1.0"/> | 249 <param name="protein" value="1.0"/> |
232 <section name="cleanup"> | 250 <section name="cleanup"> |
248 <output name="ctd_out" ftype="xml"> | 266 <output name="ctd_out" ftype="xml"> |
249 <assert_contents> | 267 <assert_contents> |
250 <is_valid_xml/> | 268 <is_valid_xml/> |
251 </assert_contents> | 269 </assert_contents> |
252 </output> | 270 </output> |
271 <assert_stdout> | |
272 <has_text_matching expression="@EXECUTABLE@ took .* \(wall\), .* \(CPU\), .* \(system\), .* \(user\)(; Peak Memory Usage: 32 MB)?."/> | |
273 </assert_stdout> | |
253 </test> | 274 </test> |
254 <!-- TOPP_FalseDiscoveryRate_6 --> | 275 <!-- TOPP_FalseDiscoveryRate_6 --> |
255 <test expect_num_outputs="2"> | 276 <test expect_num_outputs="2"> |
256 <section name="adv_opts"> | 277 <section name="adv_opts"> |
257 <param name="force" value="false"/> | 278 <param name="force" value="false"/> |
258 <param name="test" value="true"/> | 279 <param name="test" value="true"/> |
259 </section> | 280 </section> |
260 <param name="in" value="FalseDiscoveryRate_6_input.idXML"/> | 281 <param name="in" value="FalseDiscoveryRate_6_input.idXML"/> |
261 <output name="out" file="FalseDiscoveryRate_6_output.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> | 282 <output name="out" value="FalseDiscoveryRate_6_output.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> |
262 <param name="PSM" value="true"/> | 283 <param name="PSM" value="true"/> |
284 <param name="peptide" value="false"/> | |
263 <param name="protein" value="false"/> | 285 <param name="protein" value="false"/> |
264 <section name="FDR"> | 286 <section name="FDR"> |
265 <param name="PSM" value="0.05"/> | 287 <param name="PSM" value="0.05"/> |
266 <param name="protein" value="1.0"/> | 288 <param name="protein" value="1.0"/> |
267 <section name="cleanup"> | 289 <section name="cleanup"> |
283 <output name="ctd_out" ftype="xml"> | 305 <output name="ctd_out" ftype="xml"> |
284 <assert_contents> | 306 <assert_contents> |
285 <is_valid_xml/> | 307 <is_valid_xml/> |
286 </assert_contents> | 308 </assert_contents> |
287 </output> | 309 </output> |
310 <assert_stdout> | |
311 <has_text_matching expression="@EXECUTABLE@ took .* \(wall\), .* \(CPU\), .* \(system\), .* \(user\)(; Peak Memory Usage: 32 MB)?."/> | |
312 </assert_stdout> | |
288 </test> | 313 </test> |
289 <!-- TOPP_FalseDiscoveryRate_7 --> | 314 <!-- TOPP_FalseDiscoveryRate_7 --> |
290 <test expect_num_outputs="2"> | 315 <test expect_num_outputs="2"> |
291 <section name="adv_opts"> | 316 <section name="adv_opts"> |
292 <param name="force" value="true"/> | 317 <param name="force" value="true"/> |
293 <param name="test" value="true"/> | 318 <param name="test" value="true"/> |
294 </section> | 319 </section> |
295 <param name="in" value="FalseDiscoveryRate_7_input.idXML"/> | 320 <param name="in" value="FalseDiscoveryRate_7_input.idXML"/> |
296 <output name="out" file="FalseDiscoveryRate_7_output.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> | 321 <output name="out" value="FalseDiscoveryRate_7_output.idXML" compare="sim_size" delta_frac="0.7" ftype="idxml"/> |
297 <param name="PSM" value="false"/> | 322 <param name="PSM" value="false"/> |
323 <param name="peptide" value="false"/> | |
298 <param name="protein" value="true"/> | 324 <param name="protein" value="true"/> |
299 <section name="FDR"> | 325 <section name="FDR"> |
300 <param name="PSM" value="1.0"/> | 326 <param name="PSM" value="1.0"/> |
301 <param name="protein" value="0.3"/> | 327 <param name="protein" value="0.3"/> |
302 <section name="cleanup"> | 328 <section name="cleanup"> |
318 <output name="ctd_out" ftype="xml"> | 344 <output name="ctd_out" ftype="xml"> |
319 <assert_contents> | 345 <assert_contents> |
320 <is_valid_xml/> | 346 <is_valid_xml/> |
321 </assert_contents> | 347 </assert_contents> |
322 </output> | 348 </output> |
349 <assert_stdout> | |
350 <has_text_matching expression="@EXECUTABLE@ took .* \(wall\), .* \(CPU\), .* \(system\), .* \(user\)(; Peak Memory Usage: 32 MB)?."/> | |
351 </assert_stdout> | |
323 </test> | 352 </test> |
324 </tests> | 353 </tests> |
325 <help><![CDATA[Estimates the false discovery rate on peptide and protein level using decoy searches. | 354 <help><![CDATA[Estimates the false discovery rate on peptide and protein level using decoy searches. |
326 | 355 |
327 | 356 |
328 For more information, visit http://www.openms.de/doxygen/release/2.8.0/html/TOPP_FalseDiscoveryRate.html]]></help> | 357 For more information, visit https://openms.de/doxygen/release/3.1.0/html/TOPP_FalseDiscoveryRate.html]]></help> |
329 <expand macro="references"/> | 358 <expand macro="references"/> |
330 </tool> | 359 </tool> |