Mercurial > repos > galaxyp > metanovo
comparison metanovo.xml @ 5:d6dcd3173bdf draft default tip
planemo upload for repository https://github.com/galaxyproteomics/tools-galaxyp/tree/master/tools/metanovo commit fd12c123235f5067858bbd22b70fb0082d1e2199
author | galaxyp |
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date | Sat, 11 May 2024 16:46:46 +0000 |
parents | 7a5ff5359b13 |
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1 <tool id="metanovo" name="MetaNovo" version="@TOOL_VERSION@+galaxy@VERSION_SUFFIX@" profile="20.09"> | 1 <tool id="metanovo" name="MetaNovo" version="@TOOL_VERSION@+galaxy@VERSION_SUFFIX@" profile="20.09"> |
2 <description> | 2 <description> |
3 Produce targeted databases for mass spectrometry analysis. | 3 Produce targeted databases for mass spectrometry analysis. |
4 </description> | 4 </description> |
5 <requirements> | |
6 <requirement type="package" version="@TOOL_VERSION@">metanovo</requirement> | |
7 </requirements> | |
8 <macros> | 5 <macros> |
9 <token name="@TOOL_VERSION@">1.9.4</token> | 6 <token name="@TOOL_VERSION@">1.9.4</token> |
10 <token name="@VERSION_SUFFIX@">4</token> | 7 <token name="@VERSION_SUFFIX@">4</token> |
11 <token name="@SUBSTITUTION_RX@">[^\w\-\.]</token> | 8 <token name="@SUBSTITUTION_RX@">[^\w\-\.]</token> |
12 <import>macros_modifications.xml</import> | 9 <import>macros_modifications.xml</import> |
13 </macros> | 10 </macros> |
11 <xrefs> | |
12 <xref type="bio.tools">metanovo</xref> | |
13 </xrefs> | |
14 <requirements> | |
15 <requirement type="package" version="@TOOL_VERSION@">metanovo</requirement> | |
16 </requirements> | |
14 <command> | 17 <command> |
15 <![CDATA[ | 18 <![CDATA[ |
16 #import re | 19 #import re |
17 #set $mgf_dir = 'mgf_files' | 20 #set $mgf_dir = 'mgf_files' |
18 #set $fasta_dir = 'fasta_file' | 21 #set $fasta_dir = 'fasta_file' |
150 | 153 |
151 <section name="processing_control" expanded="False" title="Processing Control"> | 154 <section name="processing_control" expanded="False" title="Processing Control"> |
152 <param name="CHUNKSIZE" label="Size to split fasta for parallel processing" value="100000" type="integer" optional="true"/> | 155 <param name="CHUNKSIZE" label="Size to split fasta for parallel processing" value="100000" type="integer" optional="true"/> |
153 </section> | 156 </section> |
154 <section name="metanovo_parameters" expanded="False" title="MetaNovo Parameters"> | 157 <section name="metanovo_parameters" expanded="False" title="MetaNovo Parameters"> |
155 <param name="mn_specificity" argument="-mn_specificity" label="Enzyme Specificity" type="select"> | 158 <param argument="-mn_specificity" label="Enzyme Specificity" type="select"> |
156 <option selected="true" value="specific">specific</option> | 159 <option selected="true" value="specific">specific</option> |
157 <option value="semi-specific">semi-specific</option> | 160 <option value="semi-specific">semi-specific</option> |
158 <option value="unspecific">unspecific</option> | 161 <option value="unspecific">unspecific</option> |
159 </param> | 162 </param> |
160 <param name="mn_enzymes" argument="-mn_enzymes" label="Enzyme Rule" type="select"> | 163 <param argument="-mn_enzymes" label="Enzyme Rule" type="select"> |
161 <option value="Trypsin">Trypsin</option> | 164 <option value="Trypsin">Trypsin</option> |
162 <option selected="true" value="Trypsin, no P rule">Trypsin, no P rule</option> | 165 <option selected="true" value="Trypsin, no P rule">Trypsin, no P rule</option> |
163 <option value="Whole protein">Whole protein</option> | 166 <option value="Whole protein">Whole protein</option> |
164 </param> | 167 </param> |
165 <param name="mn_max_missed_cleavages" argument="-mn_max_missed_cleavages" label="Number of enzymatic missed cleavages" value="2" type="integer" optional="true"/> | 168 <param argument="-mn_max_missed_cleavages" label="Number of enzymatic missed cleavages" value="2" type="integer" optional="true"/> |
166 </section> | 169 </section> |
167 <section name="spectrum_matching_parameters" expanded="False" title="Spectrum Matching Parameters"> | 170 <section name="spectrum_matching_parameters" expanded="False" title="Spectrum Matching Parameters"> |
168 <param name="prec_tol" argument="-prec_tol" label="Precursor ion mass tolerance" value="10.0" type="float" optional="true"/> | 171 <param argument="-prec_tol" label="Precursor ion mass tolerance" value="10.0" type="float" optional="true"/> |
169 <param name="prec_ppm" argument="-prec_ppm" label="Precursor ion tolerance unit" type="select"> | 172 <param argument="-prec_ppm" label="Precursor ion tolerance unit" type="select"> |
170 <option value="0">Da</option> | 173 <option value="0">Da</option> |
171 <option selected="true" value="1">ppm</option> | 174 <option selected="true" value="1">ppm</option> |
172 </param> | 175 </param> |
173 <param name="frag_tol" argument="-frag_tol" label="Fragment ion mass tolerance" value="0.05" type="float" optional="true"/> | 176 <param argument="-frag_tol" label="Fragment ion mass tolerance" value="0.05" type="float" optional="true"/> |
174 <param name="frag_ppm" argument="-frag_ppm" label="Fragment ion tolerance unit" type="select"> | 177 <param argument="-frag_ppm" label="Fragment ion tolerance unit" type="select"> |
175 <option selected="true" value="0">Da</option> | 178 <option selected="true" value="0">Da</option> |
176 <option value="1">ppm</option> | 179 <option value="1">ppm</option> |
177 </param> | 180 </param> |
178 <param name="digestion" argument="-digestion" label="Digestion" type="select"> | 181 <param argument="-digestion" label="Digestion" type="select"> |
179 <option selected="true" value="0">Enzyme</option> | 182 <option selected="true" value="0">Enzyme</option> |
180 <option value="1">Unspecific</option> | 183 <option value="1">Unspecific</option> |
181 <option value="2">Whole Protein</option> | 184 <option value="2">Whole Protein</option> |
182 </param> | 185 </param> |
183 <param name="enzyme" argument="-enzyme" label="Enzyme" type="select" multiple="true"> | 186 <param argument="-enzyme" label="Enzyme" type="select" multiple="true"> |
184 <option value="Trypsin">Trypsin</option> | 187 <option value="Trypsin">Trypsin</option> |
185 <option selected="true" value="Trypsin (no P rule)">Trypsin (no P rule)</option> | 188 <option selected="true" value="Trypsin (no P rule)">Trypsin (no P rule)</option> |
186 <option value="Arg-C">Arg-C</option> | 189 <option value="Arg-C">Arg-C</option> |
187 <option value="Arg-C (no P rule)">Arg-C (no P rule)</option> | 190 <option value="Arg-C (no P rule)">Arg-C (no P rule)</option> |
188 <option value="Arg-N">Arg-N</option> | 191 <option value="Arg-N">Arg-N</option> |
197 <option value="Pepsin A">Pepsin A</option> | 200 <option value="Pepsin A">Pepsin A</option> |
198 <option value="CNBr">CNBr</option> | 201 <option value="CNBr">CNBr</option> |
199 <option value="Thermolysin">Thermolysin</option> | 202 <option value="Thermolysin">Thermolysin</option> |
200 <option value="LysargiNase">LysargiNase</option> | 203 <option value="LysargiNase">LysargiNase</option> |
201 </param> | 204 </param> |
202 <param name="specificity" argument="-specificity" label="Specificity" type="select"> | 205 <param argument="-specificity" label="Specificity" type="select"> |
203 <option selected="true" value="0">Specific</option> | 206 <option selected="true" value="0">Specific</option> |
204 <option value="1">Semi-Specific</option> | 207 <option value="1">Semi-Specific</option> |
205 <option value="2">N-term Specific</option> | 208 <option value="2">N-term Specific</option> |
206 <option value="3">C-term Specific</option> | 209 <option value="3">C-term Specific</option> |
207 </param> | 210 </param> |
208 <param name="mc" argument="-mc" label="Number of allowed missed cleavages" value="2" type="text" optional="true" help="If more than one enzyme was used, please provide the missed cleavages for every enzyme in the same order, with a comma separated list, e.g. "2, 1"."/> | 211 <param argument="-mc" label="Number of allowed missed cleavages" value="2" type="text" optional="true" help="If more than one enzyme was used, please provide the missed cleavages for every enzyme in the same order, with a comma separated list, e.g. "2, 1"."/> |
209 <param name="fixed_mods" argument="-fixed_mods" label="Fixed modifications as comma separated list" type="select" multiple="true"> | 212 <param argument="-fixed_mods" label="Fixed modifications as comma separated list" type="select" multiple="true"> |
210 <expand macro="fixed_modifications"/> | 213 <expand macro="fixed_modifications"/> |
211 </param> | 214 </param> |
212 <param name="variable_mods" argument="-variable_mods" label="Variable modifications as comma separated list" type="select" multiple="true"> | 215 <param argument="-variable_mods" label="Variable modifications as comma separated list" type="select" multiple="true"> |
213 <expand macro="variable_modifications"/> | 216 <expand macro="variable_modifications"/> |
214 </param> | 217 </param> |
215 <param name="min_charge" argument="-min_charge" label="Minimal charge to search for" value="2" type="integer" optional="true"/> | 218 <param argument="-min_charge" label="Minimal charge to search for" value="2" type="integer" optional="true"/> |
216 <param name="max_charge" argument="-max_charge" label="Maximal charge to search for" value="4" type="integer" optional="true"/> | 219 <param argument="-max_charge" label="Maximal charge to search for" value="4" type="integer" optional="true"/> |
217 <param name="fi" argument="-fi" label="Type of forward ion searched" value="b" type="text" optional="true"/> | 220 <param argument="-fi" label="Type of forward ion searched" value="b" type="text" optional="true"/> |
218 <param name="ri" argument="-ri" label="Type of rewind ion searched" value="y" type="text" optional="true"/> | 221 <param argument="-ri" label="Type of rewind ion searched" value="y" type="text" optional="true"/> |
219 <param name="min_isotope" argument="-min_isotope" label="Minimum precursor isotope" value="0" type="integer" optional="true"/> | 222 <param argument="-min_isotope" label="Minimum precursor isotope" value="0" type="integer" optional="true"/> |
220 <param name="max_isotope" argument="-max_isotope" label="Maximum precursor isotope" value="1" type="integer" optional="true"/> | 223 <param argument="-max_isotope" label="Maximum precursor isotope" value="1" type="integer" optional="true"/> |
221 </section> | 224 </section> |
222 <section name="spectrum_annotation" expanded="False" title="Spectrum Annotation"> | 225 <section name="spectrum_annotation" expanded="False" title="Spectrum Annotation"> |
223 <param name="annotation_level" argument="-annotation_level" label="The intensity threshold to consider for annotation" value="0.75" type="float" optional="true" help="Using percentiles, 0.75 means that the 25% most intense peaks will be annotated."/> | 226 <param argument="-annotation_level" label="The intensity threshold to consider for annotation" value="0.75" type="float" optional="true" help="Using percentiles, 0.75 means that the 25% most intense peaks will be annotated."/> |
224 <param name="annotation_high_resolution" argument="-annotation_high_resolution" label="If true the most accurate peak will be selected within the m/z tolerance." truevalue="1" falsevalue="0" type="boolean" checked="true"/> | 227 <param argument="-annotation_high_resolution" label="If true the most accurate peak will be selected within the m/z tolerance." truevalue="1" falsevalue="0" type="boolean" checked="true"/> |
225 </section> | 228 </section> |
226 <section name="sequence_matching" expanded="False" title="Sequence Matching"> | 229 <section name="sequence_matching" expanded="False" title="Sequence Matching"> |
227 <param name="sequence_index_type" argument="-sequence_index_type" label="sequence_index_type (deprecated)" value="0" type="integer" optional="true"/> | 230 <param argument="-sequence_index_type" label="sequence_index_type (deprecated)" value="0" type="integer" optional="true"/> |
228 <param name="sequence_matching_type" argument="-sequence_matching_type" label="The peptide to protein sequence matching type" type="select"> | 231 <param argument="-sequence_matching_type" label="The peptide to protein sequence matching type" type="select"> |
229 <option value="0">Character Sequence</option> | 232 <option value="0">Character Sequence</option> |
230 <option value="1">Amino Acids</option> | 233 <option value="1">Amino Acids</option> |
231 <option selected="true" value="2">Indistinguishable Amino Acids</option> | 234 <option selected="true" value="2">Indistinguishable Amino Acids</option> |
232 </param> | 235 </param> |
233 <param name="sequence_matching_x" argument="-sequence_matching_x" label="The maximal share of Xs in a sequence, 0.25 means 25% of X's" value="0.25" type="float" optional="true"/> | 236 <param argument="-sequence_matching_x" label="The maximal share of Xs in a sequence, 0.25 means 25% of X's" value="0.25" type="float" optional="true"/> |
234 </section> | 237 </section> |
235 <section name="import_filters" expanded="False" title="Import Filters"> | 238 <section name="import_filters" expanded="False" title="Import Filters"> |
236 <param name="import_peptide_length_min" argument="-import_peptide_length_min" label="The minimal peptide length to consider when importing identification files" value="8" type="integer" optional="true"/> | 239 <param argument="-import_peptide_length_min" label="The minimal peptide length to consider when importing identification files" value="8" type="integer" optional="true"/> |
237 <param name="import_peptide_length_max" argument="-import_peptide_length_max" label="The maximal peptide length to consider when importing identification files" value="30" type="integer" optional="true"/> | 240 <param argument="-import_peptide_length_max" label="The maximal peptide length to consider when importing identification files" value="30" type="integer" optional="true"/> |
238 <param name="import_precursor_mz_ppm" argument="-import_precurosor_mz_ppm [sic]" label="Maximal precursor ion deviation unit" type="select"> | 241 <param argument="-import_precursor_mz_ppm" label="Maximal precursor ion deviation unit" type="select"> |
239 <option selected="true" value="0">Da</option> | 242 <option selected="true" value="0">Da</option> |
240 <option value="1">ppm</option> | 243 <option value="1">ppm</option> |
241 </param> | 244 </param> |
242 <param name="exclude_unknown_ptms" argument="-exclude_unknown_ptms" label="Peptides presenting unrecognized PTMs will be excluded" truevalue="1" falsevalue="0" type="boolean" checked="true"/> | 245 <param argument="-exclude_unknown_ptms" label="Peptides presenting unrecognized PTMs will be excluded" truevalue="1" falsevalue="0" type="boolean" checked="true"/> |
243 </section> | 246 </section> |
244 <section name="ptm_localization" expanded="False" title="PTM Localization"> | 247 <section name="ptm_localization" expanded="False" title="PTM Localization"> |
245 <param name="ptm_score" argument="-ptm_score" label="The PTM probabilistic score to use for modification localization" type="select"> | 248 <param argument="-ptm_score" label="The PTM probabilistic score to use for modification localization" type="select"> |
246 <option value="0">A-score</option> | 249 <option value="0">A-score</option> |
247 <option selected="true" value="1">PhosphoRS</option> | 250 <option selected="true" value="1">PhosphoRS</option> |
248 <option value="2">None</option> | 251 <option value="2">None</option> |
249 </param> | 252 </param> |
250 <param name="score_neutral_losses" argument="-score_neutral_losses" label="Include neutral losses in spectrum annotation of the PTM score" truevalue="1" falsevalue="0" type="boolean" checked="false"/> | 253 <param argument="-score_neutral_losses" label="Include neutral losses in spectrum annotation of the PTM score" truevalue="1" falsevalue="0" type="boolean" checked="false"/> |
251 <param name="ptm_sequence_matching_type" argument="-ptm_sequence_matching_type" label="The modification to peptide sequence matching type" type="select"> | 254 <param argument="-ptm_sequence_matching_type" label="The modification to peptide sequence matching type" type="select"> |
252 <option value="0">Character Sequence</option> | 255 <option value="0">Character Sequence</option> |
253 <option selected="true" value="1">Amino Acids</option> | 256 <option selected="true" value="1">Amino Acids</option> |
254 <option value="2">Indistinguishable Amino Acids</option> | 257 <option value="2">Indistinguishable Amino Acids</option> |
255 </param> | 258 </param> |
256 <param name="ptm_alignment" argument="-ptm_alignment" label="Align peptide ambiguously localized PTMs on confident sites" truevalue="1" falsevalue="0" type="boolean" checked="true"/> | 259 <param argument="-ptm_alignment" label="Align peptide ambiguously localized PTMs on confident sites" truevalue="1" falsevalue="0" type="boolean" checked="true"/> |
257 </section> | 260 </section> |
258 <section name="gene_annotation" expanded="False" title="Gene Annotation"> | 261 <section name="gene_annotation" expanded="False" title="Gene Annotation"> |
259 <param name="useGeneMapping" argument="-useGeneMapping" label="Use and save gene mappings along with the project" truevalue="1" falsevalue="0" type="boolean" checked="true" help="UniProt databases only"/> | 262 <param argument="-useGeneMapping" label="Use and save gene mappings along with the project" truevalue="1" falsevalue="0" type="boolean" checked="true" help="UniProt databases only"/> |
260 <param name="updateGeneMapping" argument="-updateGeneMapping" label="Update gene mappings automatically from Ensembl" truevalue="1" falsevalue="0" type="boolean" checked="true" help="UniProt databases only"/> | 263 <param argument="-updateGeneMapping" label="Update gene mappings automatically from Ensembl" truevalue="1" falsevalue="0" type="boolean" checked="true" help="UniProt databases only"/> |
261 </section> | 264 </section> |
262 <section name="protein_inference" expanded="False" title="Protein Inference"> | 265 <section name="protein_inference" expanded="False" title="Protein Inference"> |
263 <param name="simplify_groups" argument="-simplify_groups" label="Simplify protein groups" truevalue="1" falsevalue="0" type="boolean" checked="true"/> | 266 <param argument="-simplify_groups" label="Simplify protein groups" truevalue="1" falsevalue="0" type="boolean" checked="true"/> |
264 <param name="simplify_score" argument="-simplify_score" label="Simplify protein groups based on the PeptideShaker target/decoy score" truevalue="1" falsevalue="0" type="boolean" checked="true"/> | 267 <param argument="-simplify_score" label="Simplify protein groups based on the PeptideShaker target/decoy score" truevalue="1" falsevalue="0" type="boolean" checked="true"/> |
265 <param name="simplify_enzymaticity" argument="-simplify_enzymaticity" label="Simplify protein groups based on the peptide enzymaticity" truevalue="1" falsevalue="0" type="boolean" checked="true"/> | 268 <param argument="-simplify_enzymaticity" label="Simplify protein groups based on the peptide enzymaticity" truevalue="1" falsevalue="0" type="boolean" checked="true"/> |
266 <param name="simplify_evidence" argument="-simplify_evidence" label="Simplify protein groups based on the UniProt protein evidence" truevalue="1" falsevalue="0" type="boolean" checked="true"/> | 269 <param argument="-simplify_evidence" label="Simplify protein groups based on the UniProt protein evidence" truevalue="1" falsevalue="0" type="boolean" checked="true"/> |
267 <param name="simplify_uncharacterized" argument="-simplify_uncharacterized" label="Simplify protein groups based on the protein characterization" truevalue="1" falsevalue="0" type="boolean" checked="true"/> | 270 <param argument="-simplify_uncharacterized" label="Simplify protein groups based on the protein characterization" truevalue="1" falsevalue="0" type="boolean" checked="true"/> |
268 </section> | 271 </section> |
269 <section name="validation_levels" expanded="False" title="Validation Levels"> | 272 <section name="validation_levels" expanded="False" title="Validation Levels"> |
270 <param name="psm_fdr" argument="-psm_fdr" label="FDR at the PSM level in percent" value="1" type="integer" optional="true"/> | 273 <param argument="-psm_fdr" label="FDR at the PSM level in percent" value="1" type="integer" optional="true"/> |
271 <param name="peptide_fdr" argument="-peptide_fdr" label="FDR at the peptide level in percent" value="1" type="integer" optional="true"/> | 274 <param argument="-peptide_fdr" label="FDR at the peptide level in percent" value="1" type="integer" optional="true"/> |
272 <param name="protein_fdr" argument="-protein_fdr" label="FDR at the protein level in percent" value="1" type="integer" optional="true"/> | 275 <param argument="-protein_fdr" label="FDR at the protein level in percent" value="1" type="integer" optional="true"/> |
273 <param name="group_psms" argument="-group_psms" label="Group PSMs by charge for scoring and validation" truevalue="1" falsevalue="0" type="boolean" checked="true"/> | 276 <param argument="-group_psms" label="Group PSMs by charge for scoring and validation" truevalue="1" falsevalue="0" type="boolean" checked="true"/> |
274 <param name="group_peptides" argument="-group_peptides" label="Group peptides by modification status for scoring and validation" truevalue="1" falsevalue="0" type="boolean" checked="true"/> | 277 <param argument="-group_peptides" label="Group peptides by modification status for scoring and validation" truevalue="1" falsevalue="0" type="boolean" checked="true"/> |
275 <param name="merge_subgroups" argument="-group_peptides" label="Merge small PSM and peptide groups for scoring and validation" truevalue="1" falsevalue="0" type="boolean" checked="true"/> | 278 <param argument="-merge_subgroups" label="Merge small PSM and peptide groups for scoring and validation" truevalue="1" falsevalue="0" type="boolean" checked="true"/> |
276 </section> | 279 </section> |
277 <section name="fraction_analysis" expanded="False" title="Fraction Analysis"> | 280 <section name="fraction_analysis" expanded="False" title="Fraction Analysis"> |
278 <param name="protein_fraction_mw_confidence" argument="-protein_fraction_mw_confidence" label="Minimum confidence required for a protein in the fraction MW plot" value="95.0" type="float" optional="true"/> | 281 <param argument="-protein_fraction_mw_confidence" label="Minimum confidence required for a protein in the fraction MW plot" value="95.0" type="float" optional="true"/> |
279 </section> | 282 </section> |
280 <section name="directag" expanded="False" title="DirecTag"> | 283 <section name="directag" expanded="False" title="DirecTag"> |
281 <param name="directag_tic_cutoff" argument="-directag_tic_cutoff" label="TIC cutoff in percent" value="85" type="integer" optional="true"/> | 284 <param argument="-directag_tic_cutoff" label="TIC cutoff in percent" value="85" type="integer" optional="true"/> |
282 <param name="directag_max_peak_count" argument="-directag_max_peak_count" label="Max peak count" value="400" type="integer" optional="true"/> | 285 <param argument="-directag_max_peak_count" label="Max peak count" value="400" type="integer" optional="true"/> |
283 <param name="directag_intensity_classes" argument="-directag_intensity_classes" label="Number of intensity classes" value="3" type="integer" optional="true"/> | 286 <param argument="-directag_intensity_classes" label="Number of intensity classes" value="3" type="integer" optional="true"/> |
284 <param name="directag_adjust_precursor" argument="-directag_adjust_precursor" label="Adjust precursor" truevalue="1" falsevalue="0" type="boolean" checked="false"/> | 287 <param argument="-directag_adjust_precursor" label="Adjust precursor" truevalue="1" falsevalue="0" type="boolean" checked="false"/> |
285 <param name="directag_min_adjustment" argument="-directag_min_adjustment" label="Minimum precursor adjustment" value="-2.5" type="float" optional="true"/> | 288 <param argument="-directag_min_adjustment" label="Minimum precursor adjustment" value="-2.5" type="float" optional="true"/> |
286 <param name="directag_max_adjustment" argument="-directag_max_adjustment" label="Maximum precursor adjustment" value="2.5" type="float" optional="true"/> | 289 <param argument="-directag_max_adjustment" label="Maximum precursor adjustment" value="2.5" type="float" optional="true"/> |
287 <param name="directag_adjustment_step" argument="-directag_adjustment_step" label="Precursor adjustment step" value="0.1" type="float" optional="true"/> | 290 <param argument="-directag_adjustment_step" label="Precursor adjustment step" value="0.1" type="float" optional="true"/> |
288 <param name="directag_charge_states" argument="-directag_charge_states" label="Number of charge states considered" value="3" type="integer" optional="true"/> | 291 <param argument="-directag_charge_states" label="Number of charge states considered" value="3" type="integer" optional="true"/> |
289 <param name="directag_ms_charge_state" argument="-directag_ms_charge_state" label="Use charge state from M spectrum" truevalue="1" falsevalue="0" type="boolean" checked="false"/> | 292 <param argument="-directag_ms_charge_state" label="Use charge state from M spectrum" truevalue="1" falsevalue="0" type="boolean" checked="false"/> |
290 <param name="directag_duplicate_spectra" argument="-directag_duplicate_spectra" label="Duplicate spectra per charge" truevalue="1" falsevalue="0" type="boolean" checked="true"/> | 293 <param argument="-directag_duplicate_spectra" label="Duplicate spectra per charge" truevalue="1" falsevalue="0" type="boolean" checked="true"/> |
291 <param name="directag_deisotoping" argument="-directag_deisotoping" label="Deisotoping mode" type="select"> | 294 <param argument="-directag_deisotoping" label="Deisotoping mode" type="select"> |
292 <option selected="true" value="0">No deisotoping</option> | 295 <option selected="true" value="0">No deisotoping</option> |
293 <option value="1">Precursor only</option> | 296 <option value="1">Precursor only</option> |
294 <option value="2">Precursor and candidate</option> | 297 <option value="2">Precursor and candidate</option> |
295 </param> | 298 </param> |
296 <param name="directag_isotope_tolerance" argument="-directag_isotope_tolerance" label="Isotope mz tolerance" value="0.25" type="float" optional="true"/> | 299 <param argument="-directag_isotope_tolerance" label="Isotope mz tolerance" value="0.25" type="float" optional="true"/> |
297 <param name="directag_complement_tolerance" argument="-directag_complement_tolerance" label="Complement mz tolerance" value="0.5" type="float" optional="true"/> | 300 <param argument="-directag_complement_tolerance" label="Complement mz tolerance" value="0.5" type="float" optional="true"/> |
298 <param name="directag_tag_length" argument="-directag_tag_length" label="Tag length" value="4" type="integer" optional="true"/> | 301 <param argument="-directag_tag_length" label="Tag length" value="4" type="integer" optional="true"/> |
299 <param name="directag_max_var_mods" argument="-directag_max_var_mods" label="Maximum variable modifications per sequence" value="2" type="integer" optional="true"/> | 302 <param argument="-directag_max_var_mods" label="Maximum variable modifications per sequence" value="2" type="integer" optional="true"/> |
300 <param name="directag_max_tag_count" argument="-directag_max_tag_count" label="Maximum tag count" value="5" type="integer" optional="true"/> | 303 <param argument="-directag_max_tag_count" label="Maximum tag count" value="5" type="integer" optional="true"/> |
301 <param name="directag_intensity_weight" argument="-directag_intensity_weight" label="Intensity score weight" value="1.0" type="float" optional="true"/> | 304 <param argument="-directag_intensity_weight" label="Intensity score weight" value="1.0" type="float" optional="true"/> |
302 <param name="directag_fidelity_weight" argument="-directag_fidelity_weight" label="Fidelity score weight" value="1.0" type="float" optional="true"/> | 305 <param argument="-directag_fidelity_weight" label="Fidelity score weight" value="1.0" type="float" optional="true"/> |
303 <param name="directag_complement_weight" argument="-directag_complement_weight" label="Complement score weight" value="1.0" type="float" optional="true"/> | 306 <param argument="-directag_complement_weight" label="Complement score weight" value="1.0" type="float" optional="true"/> |
304 </section> | 307 </section> |
305 </inputs> | 308 </inputs> |
306 <outputs> | 309 <outputs> |
307 <data name="output_fasta" format="fasta" from_work_dir="metanovo/metanovo.fasta" label="${tool.name} on ${on_string}: FASTA"/> | 310 <data name="output_fasta" format="fasta" from_work_dir="metanovo/metanovo.fasta" label="${tool.name} on ${on_string}: FASTA"/> |
308 <data name="output_csv" format="csv" from_work_dir="metanovo/metanovo.csv" label="${tool.name} on ${on_string}: CSV"/> | 311 <data name="output_csv" format="csv" from_work_dir="metanovo/metanovo.csv" label="${tool.name} on ${on_string}: CSV"/> |