Mercurial > repos > galaxyp > openms_openswathanalyzer
diff OpenSwathAnalyzer.xml @ 0:f9ead04f81ef draft
planemo upload for repository https://github.com/galaxyproteomics/tools-galaxyp/tree/master/tools/openms commit fb85d488133bb2b5f483b52b2db0ac66038fafb8
author | galaxyp |
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date | Wed, 01 Mar 2017 12:58:14 -0500 |
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children | 2473b7efa9d1 |
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--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/OpenSwathAnalyzer.xml Wed Mar 01 12:58:14 2017 -0500 @@ -0,0 +1,351 @@ +<?xml version='1.0' encoding='UTF-8'?> +<!--This is a configuration file for the integration of a tools into Galaxy (https://galaxyproject.org/). This file was automatically generated using CTD2Galaxy.--> +<!--Proposed Tool Section: [Targeted Experiments]--> +<tool id="OpenSwathAnalyzer" name="OpenSwathAnalyzer" version="2.1.0"> + <description>Picks peaks and finds features in an SRM experiment.</description> + <macros> + <token name="@EXECUTABLE@">OpenSwathAnalyzer</token> + <import>macros.xml</import> + </macros> + <expand macro="references"/> + <expand macro="stdio"/> + <expand macro="requirements"/> + <command>OpenSwathAnalyzer + +#if $param_in: + -in $param_in +#end if +#if $param_tr: + -tr $param_tr +#end if +#if $param_rt_norm: + -rt_norm $param_rt_norm +#end if +#if $param_out: + -out $param_out +#end if +#if $param_no_strict: + -no-strict +#end if +-swath_files + #for token in $param_swath_files: + $token + #end for +#if $param_min_upper_edge_dist: + -min_upper_edge_dist $param_min_upper_edge_dist +#end if +#if $param_algorithm_stop_report_after_feature: + -algorithm:stop_report_after_feature $param_algorithm_stop_report_after_feature +#end if +#if $param_algorithm_rt_extraction_window: + -algorithm:rt_extraction_window $param_algorithm_rt_extraction_window +#end if +#if $param_algorithm_rt_normalization_factor: + -algorithm:rt_normalization_factor $param_algorithm_rt_normalization_factor +#end if +#if $param_algorithm_uis_threshold_sn: + -algorithm:uis_threshold_sn $param_algorithm_uis_threshold_sn +#end if +#if $param_algorithm_uis_threshold_peak_area: + -algorithm:uis_threshold_peak_area $param_algorithm_uis_threshold_peak_area +#end if +#if $param_algorithm_TransitionGroupPicker_stop_after_feature: + -algorithm:TransitionGroupPicker:stop_after_feature $param_algorithm_TransitionGroupPicker_stop_after_feature +#end if +#if $param_algorithm_TransitionGroupPicker_stop_after_intensity_ratio: + -algorithm:TransitionGroupPicker:stop_after_intensity_ratio $param_algorithm_TransitionGroupPicker_stop_after_intensity_ratio +#end if +#if $param_algorithm_TransitionGroupPicker_PeakPickerMRM_sgolay_frame_length: + -algorithm:TransitionGroupPicker:PeakPickerMRM:sgolay_frame_length $param_algorithm_TransitionGroupPicker_PeakPickerMRM_sgolay_frame_length +#end if +#if $param_algorithm_TransitionGroupPicker_PeakPickerMRM_sgolay_polynomial_order: + -algorithm:TransitionGroupPicker:PeakPickerMRM:sgolay_polynomial_order $param_algorithm_TransitionGroupPicker_PeakPickerMRM_sgolay_polynomial_order +#end if +#if $param_algorithm_TransitionGroupPicker_PeakPickerMRM_gauss_width: + -algorithm:TransitionGroupPicker:PeakPickerMRM:gauss_width $param_algorithm_TransitionGroupPicker_PeakPickerMRM_gauss_width +#end if +#if $param_algorithm_TransitionGroupPicker_PeakPickerMRM_use_gauss: + -algorithm:TransitionGroupPicker:PeakPickerMRM:use_gauss $param_algorithm_TransitionGroupPicker_PeakPickerMRM_use_gauss +#end if +#if $param_algorithm_TransitionGroupPicker_PeakPickerMRM_peak_width: + -algorithm:TransitionGroupPicker:PeakPickerMRM:peak_width $param_algorithm_TransitionGroupPicker_PeakPickerMRM_peak_width +#end if +#if $param_algorithm_TransitionGroupPicker_PeakPickerMRM_signal_to_noise: + -algorithm:TransitionGroupPicker:PeakPickerMRM:signal_to_noise $param_algorithm_TransitionGroupPicker_PeakPickerMRM_signal_to_noise +#end if +#if $param_algorithm_TransitionGroupPicker_PeakPickerMRM_sn_win_len: + -algorithm:TransitionGroupPicker:PeakPickerMRM:sn_win_len $param_algorithm_TransitionGroupPicker_PeakPickerMRM_sn_win_len +#end if +#if $param_algorithm_TransitionGroupPicker_PeakPickerMRM_sn_bin_count: + -algorithm:TransitionGroupPicker:PeakPickerMRM:sn_bin_count $param_algorithm_TransitionGroupPicker_PeakPickerMRM_sn_bin_count +#end if +#if $param_algorithm_TransitionGroupPicker_PeakPickerMRM_write_sn_log_messages: + -algorithm:TransitionGroupPicker:PeakPickerMRM:write_sn_log_messages $param_algorithm_TransitionGroupPicker_PeakPickerMRM_write_sn_log_messages +#end if +#if $param_algorithm_TransitionGroupPicker_PeakPickerMRM_remove_overlapping_peaks: + -algorithm:TransitionGroupPicker:PeakPickerMRM:remove_overlapping_peaks +#end if +#if $param_algorithm_TransitionGroupPicker_PeakPickerMRM_method: + -algorithm:TransitionGroupPicker:PeakPickerMRM:method $param_algorithm_TransitionGroupPicker_PeakPickerMRM_method +#end if +#if $param_algorithm_DIAScoring_dia_extraction_window: + -algorithm:DIAScoring:dia_extraction_window $param_algorithm_DIAScoring_dia_extraction_window +#end if +#if $param_algorithm_DIAScoring_dia_centroided: + -algorithm:DIAScoring:dia_centroided +#end if +#if $param_algorithm_DIAScoring_dia_byseries_intensity_min: + -algorithm:DIAScoring:dia_byseries_intensity_min $param_algorithm_DIAScoring_dia_byseries_intensity_min +#end if +#if $param_algorithm_DIAScoring_dia_byseries_ppm_diff: + -algorithm:DIAScoring:dia_byseries_ppm_diff $param_algorithm_DIAScoring_dia_byseries_ppm_diff +#end if +#if $param_algorithm_DIAScoring_dia_nr_isotopes: + -algorithm:DIAScoring:dia_nr_isotopes $param_algorithm_DIAScoring_dia_nr_isotopes +#end if +#if $param_algorithm_DIAScoring_dia_nr_charges: + -algorithm:DIAScoring:dia_nr_charges $param_algorithm_DIAScoring_dia_nr_charges +#end if +#if $param_algorithm_DIAScoring_peak_before_mono_max_ppm_diff: + -algorithm:DIAScoring:peak_before_mono_max_ppm_diff $param_algorithm_DIAScoring_peak_before_mono_max_ppm_diff +#end if +#if $adv_opts.adv_opts_selector=='advanced': + #if $adv_opts.param_force: + -force +#end if + #if $adv_opts.param_model_type: + -model:type $adv_opts.param_model_type +#end if + #if $adv_opts.param_model_symmetric_regression: + -model:symmetric_regression +#end if + #if $adv_opts.param_algorithm_quantification_cutoff: + -algorithm:quantification_cutoff $adv_opts.param_algorithm_quantification_cutoff +#end if + #if $adv_opts.param_algorithm_write_convex_hull: + -algorithm:write_convex_hull +#end if + #if $adv_opts.param_algorithm_add_up_spectra: + -algorithm:add_up_spectra $adv_opts.param_algorithm_add_up_spectra +#end if + #if $adv_opts.param_algorithm_spacing_for_spectra_resampling: + -algorithm:spacing_for_spectra_resampling $adv_opts.param_algorithm_spacing_for_spectra_resampling +#end if + #if $adv_opts.param_algorithm_TransitionGroupPicker_min_peak_width: + -algorithm:TransitionGroupPicker:min_peak_width $adv_opts.param_algorithm_TransitionGroupPicker_min_peak_width +#end if + #if $adv_opts.param_algorithm_TransitionGroupPicker_background_subtraction: + -algorithm:TransitionGroupPicker:background_subtraction $adv_opts.param_algorithm_TransitionGroupPicker_background_subtraction +#end if + #if $adv_opts.param_algorithm_TransitionGroupPicker_recalculate_peaks: + -algorithm:TransitionGroupPicker:recalculate_peaks "$adv_opts.param_algorithm_TransitionGroupPicker_recalculate_peaks" +#end if + #if $adv_opts.param_algorithm_TransitionGroupPicker_recalculate_peaks_max_z: + -algorithm:TransitionGroupPicker:recalculate_peaks_max_z $adv_opts.param_algorithm_TransitionGroupPicker_recalculate_peaks_max_z +#end if + #if $adv_opts.param_algorithm_TransitionGroupPicker_minimal_quality: + -algorithm:TransitionGroupPicker:minimal_quality $adv_opts.param_algorithm_TransitionGroupPicker_minimal_quality +#end if + #if $adv_opts.param_algorithm_TransitionGroupPicker_compute_peak_quality: + -algorithm:TransitionGroupPicker:compute_peak_quality "$adv_opts.param_algorithm_TransitionGroupPicker_compute_peak_quality" +#end if + #if $adv_opts.param_algorithm_EMGScoring_interpolation_step: + -algorithm:EMGScoring:interpolation_step $adv_opts.param_algorithm_EMGScoring_interpolation_step +#end if + #if $adv_opts.param_algorithm_EMGScoring_tolerance_stdev_bounding_box: + -algorithm:EMGScoring:tolerance_stdev_bounding_box $adv_opts.param_algorithm_EMGScoring_tolerance_stdev_bounding_box +#end if + #if $adv_opts.param_algorithm_EMGScoring_max_iteration: + -algorithm:EMGScoring:max_iteration $adv_opts.param_algorithm_EMGScoring_max_iteration +#end if + #if $adv_opts.param_algorithm_EMGScoring_statistics_mean: + -algorithm:EMGScoring:statistics:mean $adv_opts.param_algorithm_EMGScoring_statistics_mean +#end if + #if $adv_opts.param_algorithm_EMGScoring_statistics_variance: + -algorithm:EMGScoring:statistics:variance $adv_opts.param_algorithm_EMGScoring_statistics_variance +#end if + #if $adv_opts.param_algorithm_Scores_use_shape_score: + -algorithm:Scores:use_shape_score $adv_opts.param_algorithm_Scores_use_shape_score +#end if + #if $adv_opts.param_algorithm_Scores_use_coelution_score: + -algorithm:Scores:use_coelution_score $adv_opts.param_algorithm_Scores_use_coelution_score +#end if + #if $adv_opts.param_algorithm_Scores_use_rt_score: + -algorithm:Scores:use_rt_score $adv_opts.param_algorithm_Scores_use_rt_score +#end if + #if $adv_opts.param_algorithm_Scores_use_library_score: + -algorithm:Scores:use_library_score $adv_opts.param_algorithm_Scores_use_library_score +#end if + #if $adv_opts.param_algorithm_Scores_use_elution_model_score: + -algorithm:Scores:use_elution_model_score $adv_opts.param_algorithm_Scores_use_elution_model_score +#end if + #if $adv_opts.param_algorithm_Scores_use_intensity_score: + -algorithm:Scores:use_intensity_score $adv_opts.param_algorithm_Scores_use_intensity_score +#end if + #if $adv_opts.param_algorithm_Scores_use_nr_peaks_score: + -algorithm:Scores:use_nr_peaks_score $adv_opts.param_algorithm_Scores_use_nr_peaks_score +#end if + #if $adv_opts.param_algorithm_Scores_use_total_xic_score: + -algorithm:Scores:use_total_xic_score $adv_opts.param_algorithm_Scores_use_total_xic_score +#end if + #if $adv_opts.param_algorithm_Scores_use_sn_score: + -algorithm:Scores:use_sn_score $adv_opts.param_algorithm_Scores_use_sn_score +#end if + #if $adv_opts.param_algorithm_Scores_use_dia_scores: + -algorithm:Scores:use_dia_scores $adv_opts.param_algorithm_Scores_use_dia_scores +#end if + #if $adv_opts.param_algorithm_Scores_use_ms1_correlation: + -algorithm:Scores:use_ms1_correlation +#end if + #if $adv_opts.param_algorithm_Scores_use_ms1_fullscan: + -algorithm:Scores:use_ms1_fullscan +#end if + #if $adv_opts.param_algorithm_Scores_use_uis_scores: + -algorithm:Scores:use_uis_scores +#end if +#end if +</command> + <inputs> + <param name="param_in" type="data" format="mzml" optional="False" label="input file containing the chromatograms" help="(-in) "/> + <param name="param_tr" type="data" format="traml" optional="False" label="transition file" help="(-tr) "/> + <param name="param_rt_norm" type="data" format="trafoxml" optional="True" label="RT normalization file (how to map the RTs of this run to the ones stored in the library)" help="(-rt_norm) "/> + <param name="param_no_strict" display="radio" type="boolean" truevalue="-no-strict" falsevalue="" checked="false" optional="True" label="run in non-strict mode and allow some chromatograms to not be mapped" help="(-no-strict) "/> + <param name="param_swath_files" type="data" format="mzml" multiple="true" optional="True" size="30" label="[applies only if you have full MS2 spectra maps] Swath files that were used to extract the transitions" help="(-swath_files) If present, SWATH specific scoring will be used"> + <sanitizer> + <valid initial="string.printable"> + <remove value="'"/> + <remove value="""/> + </valid> + </sanitizer> + </param> + <param name="param_min_upper_edge_dist" type="float" value="0.0" label="[applies only if you have full MS2 spectra maps] Minimal distance to the edge to still consider a precursor, in Thomson (only in SWATH)" help="(-min_upper_edge_dist) "/> + <param name="param_algorithm_stop_report_after_feature" type="integer" value="-1" label="Stop reporting after feature (ordered by quality; -1 means do not stop)" help="(-stop_report_after_feature) "/> + <param name="param_algorithm_rt_extraction_window" type="float" value="-1.0" label="Only extract RT around this value (-1 means extract over the whole range, a value of 500 means to extract around +/- 500 s of the expected elution)" help="(-rt_extraction_window) For this to work, the TraML input file needs to contain normalized RT values"/> + <param name="param_algorithm_rt_normalization_factor" type="float" value="1.0" label="The normalized RT is expected to be between 0 and 1. If your normalized RT has a different range, pass this here (" help="(-rt_normalization_factor) e.g. it goes from 0 to 100, set this value to 100)"/> + <param name="param_algorithm_uis_threshold_sn" type="integer" value="-1" label="S/N threshold to consider identification transition (set to -1 to consider all)" help="(-uis_threshold_sn) "/> + <param name="param_algorithm_uis_threshold_peak_area" type="integer" value="0" label="Peak area threshold to consider identification transition (set to -1 to consider all)" help="(-uis_threshold_peak_area) "/> + <param name="param_algorithm_TransitionGroupPicker_stop_after_feature" type="integer" value="-1" label="Stop finding after feature (ordered by intensity; -1 means do not stop)" help="(-stop_after_feature) "/> + <param name="param_algorithm_TransitionGroupPicker_stop_after_intensity_ratio" type="float" value="0.0001" label="Stop after reaching intensity ratio" help="(-stop_after_intensity_ratio) "/> + <param name="param_algorithm_TransitionGroupPicker_PeakPickerMRM_sgolay_frame_length" type="integer" value="15" label="The number of subsequent data points used for smoothing" help="(-sgolay_frame_length) <br>This number has to be uneven. If it is not, 1 will be added"/> + <param name="param_algorithm_TransitionGroupPicker_PeakPickerMRM_sgolay_polynomial_order" type="integer" value="3" label="Order of the polynomial that is fitted" help="(-sgolay_polynomial_order) "/> + <param name="param_algorithm_TransitionGroupPicker_PeakPickerMRM_gauss_width" type="float" value="50.0" label="Gaussian width in seconds, estimated peak size" help="(-gauss_width) "/> + <param name="param_algorithm_TransitionGroupPicker_PeakPickerMRM_use_gauss" display="radio" type="select" optional="False" value="true" label="Use Gaussian filter for smoothing (alternative is Savitzky-Golay filter)" help="(-use_gauss) "> + <option value="false">false</option> + <option value="true" selected="true">true</option> + </param> + <param name="param_algorithm_TransitionGroupPicker_PeakPickerMRM_peak_width" type="float" value="40.0" label="Force a certain minimal peak_width on the data (" help="(-peak_width) e.g. extend the peak at least by this amount on both sides) in seconds. -1 turns this feature off"/> + <param name="param_algorithm_TransitionGroupPicker_PeakPickerMRM_signal_to_noise" type="float" min="0.0" optional="True" value="1.0" label="Signal-to-noise threshold at which a peak will not be extended any more. Note that setting this too high (" help="(-signal_to_noise) e.g. 1.0) can lead to peaks whose flanks are not fully captured"/> + <param name="param_algorithm_TransitionGroupPicker_PeakPickerMRM_sn_win_len" type="float" value="1000.0" label="Signal to noise window length" help="(-sn_win_len) "/> + <param name="param_algorithm_TransitionGroupPicker_PeakPickerMRM_sn_bin_count" type="integer" value="30" label="Signal to noise bin count" help="(-sn_bin_count) "/> + <param name="param_algorithm_TransitionGroupPicker_PeakPickerMRM_write_sn_log_messages" display="radio" type="select" optional="False" value="true" label="Write out log messages of the signal-to-noise estimator in case of sparse windows or median in rightmost histogram bin" help="(-write_sn_log_messages) "> + <option value="true" selected="true">true</option> + <option value="false">false</option> + </param> + <param name="param_algorithm_TransitionGroupPicker_PeakPickerMRM_remove_overlapping_peaks" display="radio" type="boolean" truevalue="-algorithm:TransitionGroupPicker:PeakPickerMRM:remove_overlapping_peaks" falsevalue="" checked="false" optional="True" label="Try to remove overlapping peaks during peak picking" help="(-remove_overlapping_peaks) "/> + <param name="param_algorithm_TransitionGroupPicker_PeakPickerMRM_method" display="radio" type="select" optional="False" value="legacy" label="Which method to choose for chromatographic peak-picking (OpenSWATH legacy, corrected picking or Crawdad)" help="(-method) "> + <option value="legacy" selected="true">legacy</option> + <option value="corrected">corrected</option> + <option value="crawdad">crawdad</option> + </param> + <param name="param_algorithm_DIAScoring_dia_extraction_window" type="float" min="0.0" optional="True" value="0.05" label="DIA extraction window in Th" help="(-dia_extraction_window) "/> + <param name="param_algorithm_DIAScoring_dia_centroided" display="radio" type="boolean" truevalue="-algorithm:DIAScoring:dia_centroided" falsevalue="" checked="false" optional="True" label="Use centroded DIA data" help="(-dia_centroided) "/> + <param name="param_algorithm_DIAScoring_dia_byseries_intensity_min" type="float" min="0.0" optional="True" value="300.0" label="DIA b/y series minimum intensity to conside" help="(-dia_byseries_intensity_min) "/> + <param name="param_algorithm_DIAScoring_dia_byseries_ppm_diff" type="float" min="0.0" optional="True" value="10.0" label="DIA b/y series minimal difference in ppm to conside" help="(-dia_byseries_ppm_diff) "/> + <param name="param_algorithm_DIAScoring_dia_nr_isotopes" type="integer" min="0" optional="True" value="4" label="DIA nr of isotopes to conside" help="(-dia_nr_isotopes) "/> + <param name="param_algorithm_DIAScoring_dia_nr_charges" type="integer" min="0" optional="True" value="4" label="DIA nr of charges to conside" help="(-dia_nr_charges) "/> + <param name="param_algorithm_DIAScoring_peak_before_mono_max_ppm_diff" type="float" min="0.0" optional="True" value="20.0" label="DIA maximal difference in ppm to count a peak at lower m/z when searching for evidence that a peak might not be monoisotopic" help="(-peak_before_mono_max_ppm_diff) "/> + <expand macro="advanced_options"> + <param name="param_force" display="radio" type="boolean" truevalue="-force" falsevalue="" checked="false" optional="True" label="Overwrite tool specific checks" help="(-force) "/> + <param name="param_model_type" display="radio" type="select" optional="False" value="linear" label="Type of model" help="(-type) "> + <option value="linear" selected="true">linear</option> + <option value="b_spline">b_spline</option> + <option value="interpolated">interpolated</option> + <option value="lowess">lowess</option> + </param> + <param name="param_model_symmetric_regression" display="radio" type="boolean" truevalue="-model:symmetric_regression" falsevalue="" checked="false" optional="True" label="Only for 'linear' model: Perform linear regression on 'y - x' vs" help="(-symmetric_regression) 'y + x', instead of on 'y' vs. 'x'"/> + <param name="param_algorithm_quantification_cutoff" type="float" min="0.0" optional="True" value="0.0" label="Cutoff in m/z below which peaks should not be used for quantification any more" help="(-quantification_cutoff) "/> + <param name="param_algorithm_write_convex_hull" display="radio" type="boolean" truevalue="-algorithm:write_convex_hull" falsevalue="" checked="false" optional="True" label="Whether to write out all points of all features into the featureXML" help="(-write_convex_hull) "/> + <param name="param_algorithm_add_up_spectra" type="integer" min="1" optional="True" value="1" label="Add up spectra around the peak apex (needs to be a non-even integer)" help="(-add_up_spectra) "/> + <param name="param_algorithm_spacing_for_spectra_resampling" type="float" min="0.0" optional="True" value="0.005" label="If spectra are to be added, use this spacing to add them up" help="(-spacing_for_spectra_resampling) "/> + <param name="param_algorithm_TransitionGroupPicker_min_peak_width" type="float" value="-1.0" label="Minimal peak width (s), discard all peaks below this value (-1 means no action)" help="(-min_peak_width) "/> + <param name="param_algorithm_TransitionGroupPicker_background_subtraction" display="radio" type="select" optional="False" value="none" label="Try to apply a background subtraction to the peak (experimental)" help="(-background_subtraction) The background is estimated at the peak boundaries, either the smoothed or the raw chromatogram data can be used for that"> + <option value="none" selected="true">none</option> + <option value="smoothed">smoothed</option> + <option value="original">original</option> + </param> + <param name="param_algorithm_TransitionGroupPicker_recalculate_peaks" type="text" size="30" value="false" label="Tries to get better peak picking by looking at peak consistency of all picked peaks" help="(-recalculate_peaks) Tries to use the consensus (median) peak border if theof variation within the picked peaks is too large"> + <sanitizer> + <valid initial="string.printable"> + <remove value="'"/> + <remove value="""/> + </valid> + </sanitizer> + </param> + <param name="param_algorithm_TransitionGroupPicker_recalculate_peaks_max_z" type="float" value="1.0" label="Determines the maximal Z-Score (difference measured in standard deviations) that is considered too large for peak boundaries" help="(-recalculate_peaks_max_z) If the Z-Score is above this value, the median is used for peak boundaries (default value 1.0)"/> + <param name="param_algorithm_TransitionGroupPicker_minimal_quality" type="float" value="-10000.0" label="Only if compute_peak_quality is set, this parameter will not consider peaks below this quality threshold" help="(-minimal_quality) "/> + <param name="param_algorithm_TransitionGroupPicker_compute_peak_quality" type="text" size="30" value="false" label="Tries to compute a quality value for each peakgroup and detect outlier transitions" help="(-compute_peak_quality) The resulting score is centered around zero and values above 0 are generally good and below -1 or -2 are usually bad"> + <sanitizer> + <valid initial="string.printable"> + <remove value="'"/> + <remove value="""/> + </valid> + </sanitizer> + </param> + <param name="param_algorithm_EMGScoring_interpolation_step" type="float" value="0.2" label="Sampling rate for the interpolation of the model function" help="(-interpolation_step) "/> + <param name="param_algorithm_EMGScoring_tolerance_stdev_bounding_box" type="float" value="3.0" label="Bounding box has range [minimim of data, maximum of data] enlarged by tolerance_stdev_bounding_box times the standard deviation of the data" help="(-tolerance_stdev_bounding_box) "/> + <param name="param_algorithm_EMGScoring_max_iteration" type="integer" value="500" label="Maximum number of iterations using by Levenberg-Marquardt algorithm" help="(-max_iteration) "/> + <param name="param_algorithm_EMGScoring_statistics_mean" type="float" value="1.0" label="Centroid position of the model" help="(-mean) "/> + <param name="param_algorithm_EMGScoring_statistics_variance" type="float" value="1.0" label="Variance of the model" help="(-variance) "/> + <param name="param_algorithm_Scores_use_shape_score" display="radio" type="select" optional="False" value="true" label="Use the shape score (this score measures the similarity in shape of the transitions using a cross-correlation)" help="(-use_shape_score) "> + <option value="true" selected="true">true</option> + <option value="false">false</option> + </param> + <param name="param_algorithm_Scores_use_coelution_score" display="radio" type="select" optional="False" value="true" label="Use the coelution score (this score measures the similarity in coelution of the transitions using a cross-correlation)" help="(-use_coelution_score) "> + <option value="true" selected="true">true</option> + <option value="false">false</option> + </param> + <param name="param_algorithm_Scores_use_rt_score" display="radio" type="select" optional="False" value="true" label="Use the retention time score (this score measure the difference in retention time)" help="(-use_rt_score) "> + <option value="true" selected="true">true</option> + <option value="false">false</option> + </param> + <param name="param_algorithm_Scores_use_library_score" display="radio" type="select" optional="False" value="true" label="Use the library score" help="(-use_library_score) "> + <option value="true" selected="true">true</option> + <option value="false">false</option> + </param> + <param name="param_algorithm_Scores_use_elution_model_score" display="radio" type="select" optional="False" value="true" label="Use the elution model (EMG) score (this score fits a gaussian model to the peak and checks the fit)" help="(-use_elution_model_score) "> + <option value="true" selected="true">true</option> + <option value="false">false</option> + </param> + <param name="param_algorithm_Scores_use_intensity_score" display="radio" type="select" optional="False" value="true" label="Use the intensity score" help="(-use_intensity_score) "> + <option value="true" selected="true">true</option> + <option value="false">false</option> + </param> + <param name="param_algorithm_Scores_use_nr_peaks_score" display="radio" type="select" optional="False" value="true" label="Use the number of peaks score" help="(-use_nr_peaks_score) "> + <option value="true" selected="true">true</option> + <option value="false">false</option> + </param> + <param name="param_algorithm_Scores_use_total_xic_score" display="radio" type="select" optional="False" value="true" label="Use the total XIC score" help="(-use_total_xic_score) "> + <option value="true" selected="true">true</option> + <option value="false">false</option> + </param> + <param name="param_algorithm_Scores_use_sn_score" display="radio" type="select" optional="False" value="true" label="Use the SN (signal to noise) score" help="(-use_sn_score) "> + <option value="true" selected="true">true</option> + <option value="false">false</option> + </param> + <param name="param_algorithm_Scores_use_dia_scores" display="radio" type="select" optional="False" value="true" label="Use the DIA (SWATH) scores" help="(-use_dia_scores) "> + <option value="true" selected="true">true</option> + <option value="false">false</option> + </param> + <param name="param_algorithm_Scores_use_ms1_correlation" display="radio" type="boolean" truevalue="-algorithm:Scores:use_ms1_correlation" falsevalue="" checked="false" optional="True" label="Use the correlation scores with the MS1 elution profiles" help="(-use_ms1_correlation) "/> + <param name="param_algorithm_Scores_use_ms1_fullscan" display="radio" type="boolean" truevalue="-algorithm:Scores:use_ms1_fullscan" falsevalue="" checked="false" optional="True" label="Use the full MS1 scan at the peak apex for scoring (ppm accuracy of precursor and isotopic pattern)" help="(-use_ms1_fullscan) "/> + <param name="param_algorithm_Scores_use_uis_scores" display="radio" type="boolean" truevalue="-algorithm:Scores:use_uis_scores" falsevalue="" checked="false" optional="True" label="Use UIS scores for peptidoform identification" help="(-use_uis_scores) "/> + </expand> + </inputs> + <outputs> + <data name="param_out" format="featurexml"/> + </outputs> + <help>Picks peaks and finds features in an SRM experiment. + + +For more information, visit http://ftp.mi.fu-berlin.de/OpenMS/release-documentation/html/TOPP_OpenSwathAnalyzer.html</help> +</tool>