Repository revision
14:3cf310697624

Repository 'msconvert'
hg clone https://toolshed.g2.bx.psu.edu/repos/galaxyp/msconvert

msconvert tool metadata
Miscellaneous
msconvert
Convert and/or filter mass spectrometry files
msconvert
toolshed.g2.bx.psu.edu/repos/galaxyp/msconvert/msconvert/3.0.19052.1
3.0.19052.1
None
True
Version lineage of this tool (guids ordered most recent to oldest)
toolshed.g2.bx.psu.edu/repos/galaxyp/msconvert/msconvert/3.0.20287.2
toolshed.g2.bx.psu.edu/repos/galaxyp/msconvert/msconvert/3.0.19052.1 (this tool)
toolshed.g2.bx.psu.edu/repos/galaxyp/msconvert/msconvert/3.0.19052.0
toolshed.g2.bx.psu.edu/repos/galaxyp/msconvert/msconvert/0.3.0
msconvert
Requirements (dependencies defined in the <requirements> tag set)
No requirements defined
Functional tests
name inputs outputs required files
Test-1 input: small.mzML
license_agreement: True
output_type: mzML
data_processing|peak_picking|pick_peaks_ms_levels: 1-
data_processing|peak_picking|pick_peaks_algorithm: cwt
data_processing|peak_picking|pick_peaks: True
name: value
small.mzML
value
Test-2 input: small.RAW
license_agreement: True
output_type: mzML
data_processing|peak_picking|pick_peaks_ms_levels: 1-
data_processing|peak_picking|pick_peaks_algorithm: vendor
data_processing|peak_picking|pick_peaks: True
name: value
small.RAW
value
Test-3 input: ThyroglobMRM000003.d.tar
license_agreement: True
output_type: mzML
general_options|combineIonMobilitySpectra: True
general_options|scan_summing|do_scan_summing: True
name: value
ThyroglobMRM000003.d.tar
value
Test-4 input: MassLynxTest.raw.tar
license_agreement: True
output_type: mzML
name: value
MassLynxTest.raw.tar
value
Test-5 input: AgilentMassHunterTest.d.tar
license_agreement: True
output_type: mzXML
name: value
AgilentMassHunterTest.d.tar
value
Test-6 input: BrukerBafTest.d.tar
license_agreement: True
output_type: mzML
data_processing|peak_picking|pick_peaks_ms_levels: 1-
data_processing|peak_picking|pick_peaks_algorithm: vendor
data_processing|peak_picking|pick_peaks: True
name: value
BrukerBafTest.d.tar
value
Test-7 input: SciexTest.wiff.tar
license_agreement: True
output_type: mzML
general_options|multi_run_output|runIndexSet: 0
general_options|multi_run_output|do_multi_run_output: False
name: value
SciexTest.wiff.tar
value
Test-8 input: SciexTest.wiff.tar
license_agreement: True
output_type: mzXML
filtering|indices_0|from: 0
filtering|indices_0|to: 499
general_options|srmAsSpectra: True
general_options|multi_run_output|runIndexSet: 0
general_options|multi_run_output|do_multi_run_output: False
name: value
SciexTest.wiff.tar
value
Test-9 input: SciexTest.wiff.tar
license_agreement: True
output_type: mzXML
filtering|indices_0|from: 0
filtering|indices_0|to: 499
general_options|srmAsSpectra: True
general_options|multi_run_output|runIndexSet: 1
general_options|multi_run_output|do_multi_run_output: False
name: value
SciexTest.wiff.tar
value
Test-10 input: SciexTest.wiff.tar
license_agreement: True
output_type: mzML
general_options|multi_run_output|run_index_set_0|from: 0
general_options|multi_run_output|run_index_set_0|to: 1
general_options|multi_run_output|do_multi_run_output: True
SciexTest.wiff.tar
Test-11 input: SciexTest.wiff.tar
license_agreement: True
output_type: mzML
general_options|multi_run_output|do_multi_run_output: True
SciexTest.wiff.tar
Test-12 input: small.mzML
license_agreement: True
output_type: mzML
data_processing|peak_picking|pick_peaks_ms_levels: 1
data_processing|peak_picking|pick_peaks_algorithm: cwt
data_processing|peak_picking|pick_peaks: True
name: value
small.mzML
value
Test-13 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mz5
settings|mz_encoding: 64
settings|intensity_encoding: 64
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-14 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzXML
settings|mz_encoding: 32
settings|intensity_encoding: 32
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-15 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-16 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
settings|binary_compression: numpressLinearSlof
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-17 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
settings|binary_compression: numpressLinear
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-18 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
settings|binary_compression: numpressPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-19 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
settings|binary_compression: numpressSlof
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-20 input: Rpal_01.mz5
license_agreement: True
output_type: mzML
data_processing|precursor_refinement|input_ident: Rpal_01.pepXML
data_processing|precursor_refinement|thresholdScore: mvh
data_processing|precursor_refinement|thresholdValue: 40-
data_processing|precursor_refinement|use_mzrefinement: True
settings|binary_compression: numpressLinearPic
name: value
name: value
Rpal_01.mz5
Rpal_01.pepXML
value
Test-21 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
data_processing|charge_state_calculation|predictor_overrideExistingCharge: True
data_processing|charge_state_calculation|minMultipleCharge: 2
data_processing|charge_state_calculation|maxMultipleCharge: 5
data_processing|charge_state_calculation|singleChargeFractionTIC: 0.95
data_processing|charge_state_calculation|maxKnownCharge: 8
data_processing|charge_state_calculation|charge_state_calculation_method: predictor
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-22 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
data_processing|charge_state_calculation|minCharge: 1
data_processing|charge_state_calculation|maxCharge: 5
data_processing|charge_state_calculation|precursorsBefore: 1
data_processing|charge_state_calculation|precursorsAfter: 1
data_processing|charge_state_calculation|halfIsoWidth: 1.5
data_processing|charge_state_calculation|defaultMinCharge: 1
data_processing|charge_state_calculation|defaultMaxCharge: 5
data_processing|charge_state_calculation|charge_state_calculation_method: turbocharger
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-23 input: D100930_yeast_SCX10S_rak_ft8E_pc_01.mz5
license_agreement: True
output_type: mzML
data_processing|etd_filtering|remove_precursor: true
data_processing|etd_filtering|remove_charge_reduced: true
data_processing|etd_filtering|remove_neutral_loss: false
data_processing|etd_filtering|blanket_removal: false
data_processing|etd_filtering|matching_tolerance: 50
data_processing|etd_filtering|matching_tolerance_units: PPM
data_processing|etd_filtering|do_etd_filtering: True
settings|binary_compression: numpressLinearPic
name: value
D100930_yeast_SCX10S_rak_ft8E_pc_01.mz5
value
Test-24 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
data_processing|thresholds_0|threshold_type: count
data_processing|thresholds_0|value: 100
data_processing|thresholds_0|orientation: most-intense
data_processing|thresholds_1|threshold_type: absolute
data_processing|thresholds_1|value: 1
data_processing|thresholds_1|orientation: most-intense
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-25 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
data_processing|filter_mz_windows|mz_window_from: 420
data_processing|filter_mz_windows|mz_window_to: 840
data_processing|filter_mz_windows|do_mzwindow_filter: True
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-26 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
data_processing|ms2denoise|num_peaks: 10
data_processing|ms2denoise|window_width: 40
data_processing|ms2denoise|relax: False
data_processing|ms2denoise|denoise: True
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-27 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
data_processing|ms2deisotope: True
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-28 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
filtering|activation: CID
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-29 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
filtering|indices_0|from: 2
filtering|indices_0|to: 4
filtering|indices_1|from: 10
filtering|indices_1|to: 10
filtering|indices_2|from: 13
filtering|indices_2|to: 15
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-30 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
filtering|strip_it: True
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-31 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
filtering|filter_ms_levels|ms_level_from: 2
filtering|filter_ms_levels|ms_level_to: 2
filtering|filter_ms_levels|do_ms_level_filter: True
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-32 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
filtering|polarity: positive
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-33 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
filtering|analyzer: IT
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value
Test-34 input: small-peakpicking-cwt-allMS.mzML
license_agreement: True
output_type: mzML
filtering|scan_numbers_0|from: 3
filtering|scan_numbers_0|to: 5
filtering|scan_numbers_1|from: 11
filtering|scan_numbers_1|to: 11
filtering|scan_numbers_2|from: 14
filtering|scan_numbers_2|to: 16
settings|binary_compression: numpressLinearPic
name: value
small-peakpicking-cwt-allMS.mzML
value