Repository revision
15:fe4e4587d265

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

FileFilter tool metadata
Miscellaneous
FileFilter
Extracts or manipulates portions of data from peak, feature or consensus-feature files.
FileFilter
toolshed.g2.bx.psu.edu/repos/galaxyp/openms_filefilter/FileFilter/2.8+galaxy0
2.8+galaxy0
None
True
Version lineage of this tool (guids ordered most recent to oldest)
toolshed.g2.bx.psu.edu/repos/galaxyp/openms_filefilter/FileFilter/2.8+galaxy0 (this tool)
toolshed.g2.bx.psu.edu/repos/galaxyp/openms_filefilter/FileFilter/2.6+galaxy0
toolshed.g2.bx.psu.edu/repos/galaxyp/openms_filefilter/FileFilter/2.5+galaxy0
toolshed.g2.bx.psu.edu/repos/galaxyp/openms_filefilter/FileFilter/2.3.0
toolshed.g2.bx.psu.edu/repos/galaxyp/openms_filefilter/FileFilter/2.2.0
toolshed.g2.bx.psu.edu/repos/galaxyp/openms_filefilter/FileFilter/2.1.0
FileFilter
Requirements (dependencies defined in the <requirements> tag set)
name version type
openms 2.8 package
openms-thirdparty 2.8 package
omssa 2.1.9 package
blast 2.13.0 package
ctdopts 1.4 package
Additional information about this tool
#def quote(s):
    #set $s = [ _ for _ in $s.split(" ") if _ != "" ]
    #set $q = False
    #for $i, $p in enumerate($s):
        #if $p == "":
            #continue
        #end if
        #if $p.startswith('"'):
            #set $q = True
        #end if
##        #if p.startswith('-'):
##            #set p = "\\" + p
##        #elif p.startswith('"-'):
##            #set p = "\\" + p[1:]
##        #end if
        #if not $q:
            #set $s[i] = '"%s"' % p
        #end if
        #if $p.endswith('"'):
            #set $q = False
        #end if
    #end for
    #return " ".join($s)
#end def
  
#def oms2gxyext(o)
    #set m={'txt': 'txt', 'tsv': 'tabular', 'bioml': 'xml', 'consensusXML': 'consensusxml', 'csv': 'csv', 'dta': 'dta', 'dta2d': 'dta2d', 'edta': 'edta', 'fa': 'fasta', 'fas': 'fasta', 'fasta': 'fasta', 'FASTA': 'fasta', 'featureXML': 'featurexml', 'featurexml': 'featurexml', 'html': 'html', 'HTML': 'html', 'idXML': 'idxml', 'json': 'json', 'kroenik': 'kroenik', 'mascotXML': 'mascotxml', 'mgf': 'mgf', 'mrm': 'mrm', 'ms': 'sirius.ms', 'ms2': 'ms2', 'msp': 'msp', 'mzData': 'mzdata', 'mzid': 'mzid', 'mzML': 'mzml', 'mzml': 'mzml', 'mzq': 'mzq', 'mzQC': 'mzqc', 'mzTab': 'mztab', 'mzXML': 'mzxml', 'novor': 'txt', 'obo': 'obo', 'oms': 'sqlite', 'omssaXML': 'idxml', 'osw': 'osw', 'OSW': 'osw', 'params': 'txt', 'paramXML': 'paramxml', 'peplist': 'peplist', 'pep.xml': 'pepxml', 'pepXML': 'pepxml', 'png': 'png', 'PNG': 'png', 'protXML': 'protxml', 'psms': 'psms', 'pqp': 'pqp', 'qcML': 'qcml', 'spec.xml': 'spec.xml', 'splib': 'splib', 'sqMass': 'sqmass', 'tandem.xml': 'tandem', 'trafoXML': 'trafoxml', 'traML': 'traml', 'TraML': 'traml', 'tab': 'tabular', 'raw': 'thermo.raw', 'xls': 'tsv', 'XML': 'xml', 'xml': 'xml', 'xquest.xml': 'xquest.xml', 'xsd': 'xml'}
    #return m[o]
#end def
#def gxy2omsext(g)
    #set m={'txt': 'txt', 'tabular': 'tsv', 'xml': 'bioml', 'consensusxml': 'consensusXML', 'csv': 'csv', 'dta': 'dta', 'dta2d': 'dta2d', 'edta': 'edta', 'fasta': 'fa', 'featurexml': 'featureXML', 'html': 'html', 'idxml': 'idXML', 'json': 'json', 'kroenik': 'kroenik', 'mascotxml': 'mascotXML', 'mgf': 'mgf', 'mrm': 'mrm', 'sirius.ms': 'ms', 'ms2': 'ms2', 'msp': 'msp', 'mzdata': 'mzData', 'mzid': 'mzid', 'mzml': 'mzML', 'mzq': 'mzq', 'mzqc': 'mzQC', 'mztab': 'mzTab', 'mzxml': 'mzXML', 'obo': 'obo', 'sqlite': 'oms', 'osw': 'osw', 'paramxml': 'paramXML', 'peff': 'fasta', 'peplist': 'peplist', 'pepxml': 'pep.xml', 'png': 'png', 'protxml': 'protXML', 'psms': 'psms', 'pqp': 'pqp', 'qcml': 'qcML', 'spec.xml': 'spec.xml', 'splib': 'splib', 'sqmass': 'sqMass', 'tandem': 'tandem.xml', 'trafoxml': 'trafoXML', 'traml': 'traML', 'thermo.raw': 'raw', 'tsv': 'xls', 'xquest.xml': 'xquest.xml'}
    #return m[g]
#end def

#import re

## Preprocessing
mkdir in &&
ln -s '$in' 'in/${re.sub("[^\w\-_]", "_", $in.element_identifier)}.$gxy2omsext($in.ext)' &&
mkdir out &&
#if $spectra.blackorwhitelist.file:
  mkdir spectra.blackorwhitelist.file &&
  ln -s '$spectra.blackorwhitelist.file' 'spectra.blackorwhitelist.file/${re.sub("[^\w\-_]", "_", $spectra.blackorwhitelist.file.element_identifier)}.$gxy2omsext($spectra.blackorwhitelist.file.ext)' &&
#end if
#if $consensus.blackorwhitelist.file:
  mkdir consensus.blackorwhitelist.file &&
  ln -s '$consensus.blackorwhitelist.file' 'consensus.blackorwhitelist.file/${re.sub("[^\w\-_]", "_", $consensus.blackorwhitelist.file.element_identifier)}.$gxy2omsext($consensus.blackorwhitelist.file.ext)' &&
#end if
#if $id.blacklist:
  mkdir id.blacklist &&
  ln -s '$id.blacklist' 'id.blacklist/${re.sub("[^\w\-_]", "_", $id.blacklist.element_identifier)}.$gxy2omsext($id.blacklist.ext)' &&
#end if

## Main program call

set -o pipefail &&
FileFilter -write_ctd ./ &&
python3 '$__tool_directory__/fill_ctd.py' 'FileFilter.ctd' '$args_json' '$hardcoded_json' &&
FileFilter -ini FileFilter.ctd
-in
'in/${re.sub("[^\w\-_]", "_", $in.element_identifier)}.$gxy2omsext($in.ext)'
-out
'out/output.${out_type}'
#if $spectra.blackorwhitelist.file:
  -spectra:blackorwhitelist:file
  'spectra.blackorwhitelist.file/${re.sub("[^\w\-_]", "_", $spectra.blackorwhitelist.file.element_identifier)}.$gxy2omsext($spectra.blackorwhitelist.file.ext)'
#end if
#if $consensus.blackorwhitelist.file:
  -consensus:blackorwhitelist:file
  'consensus.blackorwhitelist.file/${re.sub("[^\w\-_]", "_", $consensus.blackorwhitelist.file.element_identifier)}.$gxy2omsext($consensus.blackorwhitelist.file.ext)'
#end if
#if $id.blacklist:
  -id:blacklist
  'id.blacklist/${re.sub("[^\w\-_]", "_", $id.blacklist.element_identifier)}.$gxy2omsext($id.blacklist.ext)'
#end if

## Postprocessing
&& mv 'out/output.${out_type}' '$out'
#if "ctd_out_FLAG" in $OPTIONAL_OUTPUTS
  && mv 'FileFilter.ctd' '$ctd_out'
#end if
None
False
Functional tests
name inputs outputs required files
Test-1 in: FileFilter_1_input.mzML
out_type: mzML
rt: :30
mz: :1000
int: :20000
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_1_input.mzML
value
Test-2 in: FileFilter_1_input.mzML
out_type: mzML
rt: 30:
mz: 1000:
int: 100:
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_1_input.mzML
value
Test-3 in: FileFilter_1_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 2
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_1_input.mzML
value
Test-4 in: FileFilter_4_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: True
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_4_input.mzML
value
Test-5 in: FileFilter_5_input.featureXML
out_type: featureXML
rt: :1000
mz: :480
int: :79000
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :0.6
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :3
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_5_input.featureXML
value
Test-6 in: FileFilter_5_input.featureXML
out_type: featureXML
rt: 1000:
mz: 440:
int: 70000:
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: 0.51:
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: 3:
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_5_input.featureXML
value
Test-7 in: FileFilter_7_input.mzML
out_type: mzML
rt: :
mz: :
int: 7000:
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_7_input.mzML
value
Test-8 in: FileFilter_8_input.consensusXML
out_type: consensusXML
rt: 600:1400
mz: 700:2300
int: 1100:6000
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_8_input.consensusXML
value
Test-9 in: FileFilter_9_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: SelectedIonMonitoring
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_9_input.mzML
value
Test-10 in: FileFilter_10_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: Collision-induced dissociation
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_10_input.mzML
value
Test-11 in: FileFilter_11_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: Plasma desorption
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_11_input.mzML
value
Test-12 in: FileFilter_12_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: True
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_12_input.mzML
value
Test-13 in: FileFilter_13_input.consensusXML
out_type: featureXML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map: 2
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_13_input.consensusXML
value
Test-14 in: FileFilter_14_input.consensusXML
out_type: consensusXML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map: 0 2
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_14_input.consensusXML
value
Test-15 in: FileFilter_15_input.featureXML
out_type: featureXML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist: "Oxidation"
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: True
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_15_input.featureXML
value
Test-16 in: FileFilter_15_input.featureXML
out_type: featureXML
rt: 3000:4000
mz: 400:600
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist: "Oxidation"
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: True
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_15_input.featureXML
value
Test-17 in: FileFilter_15_input.featureXML
out_type: featureXML
rt: 3000:4000
mz: 400:600
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: True
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_15_input.featureXML
value
Test-18 in: FileFilter_18_input.consensusXML
out_type: consensusXML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist: "Oxidation"
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: True
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_18_input.consensusXML
value
Test-19 in: FileFilter_18_input.consensusXML
out_type: consensusXML
rt: 3000:4000
mz: 400:600
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: True
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_18_input.consensusXML
value
Test-20 in: FileFilter_15_input.featureXML
out_type: featureXML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist: "YDL217C"
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: True
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_15_input.featureXML
value
Test-21 in: FileFilter_15_input.featureXML
out_type: featureXML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: True
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: True
id|remove_unassigned_ids: True
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_15_input.featureXML
value
Test-22 in: FileFilter_22_input.consensusXML
out_type: consensusXML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta: "distinct_charges" "gt" "1,2"
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_22_input.consensusXML
value
Test-23 in: FileFilter_22_input.consensusXML
out_type: consensusXML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta: "distinct_charges_size" "gt" "2"
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_22_input.consensusXML
value
Test-24 in: FileFilter_22_input.consensusXML
out_type: consensusXML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta: "DOESNOTEXIST" "lt" "whatever"
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_22_input.consensusXML
value
Test-25 in: FileFilter_25_input.mzML.gz
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|blacklist: FileFilter_25_input.idXML
id|rt: 1.0
id|mz: 0.05
id|blacklist_imperfect: True
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_25_input.mzML.gz
FileFilter_25_input.idXML
value
Test-26 in: FileFilter_25_input.mzML.gz
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|blacklist: FileFilter_25_input.idXML
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: True
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_25_input.mzML.gz
FileFilter_25_input.idXML
value
Test-27 in: FileFilter_28_input.mzML.gz
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: 832:836
peak_options|pc_mz_list:
peak_options|level: 2
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_28_input.mzML.gz
value
Test-28 in: FileFilter_28_input.mzML.gz
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: 832:836
peak_options|pc_mz_list:
peak_options|level: 1 2
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_28_input.mzML.gz
value
Test-29 in: FileFilter_28_input.mzML.gz
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: 832:836
peak_options|pc_mz_list:
peak_options|level: 1 2
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_28_input.mzML.gz
value
Test-30 in: FileFilter_31_34_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :2
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_31_34_input.mzML
value
Test-31 in: FileFilter_31_34_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :2
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_31_34_input.mzML
value
Test-32 in: FileFilter_31_34_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :35
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_31_34_input.mzML
value
Test-33 in: FileFilter_31_34_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :35
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_31_34_input.mzML
value
Test-34 in: FileFilter_1_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_1_input.mzML
value
Test-35 in: FileFilter_1_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: False
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_1_input.mzML
value
Test-36 in: FileFilter_1_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: linear
peak_options|numpress|lossy_mass_accuracy: 0.0001
peak_options|numpress|intensity: slof
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_1_input.mzML
value
Test-37 in: FileFilter_1_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: linear
peak_options|numpress|lossy_mass_accuracy: 0.0001
peak_options|numpress|intensity: pic
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_1_input.mzML
value
Test-38 in: FileFilter_40_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: positive
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_40_input.mzML
value
Test-39 in: FileFilter_40_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: negative
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_40_input.mzML
value
Test-40 in: FileFilter_40_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_40_input.mzML
value
Test-41 in: FileFilter_43_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_43_input.mzML
value
Test-42 in: FileFilter_43.tmp.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_43.tmp.mzML
value
Test-43 in: FileFilter_44_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_44_input.mzML
value
Test-44 in: FileFilter_45_input.featureXML
out_type: featureXML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist: "YSFS" "STLIPPPSK(Label:13C(6)15N(2))"
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_45_input.featureXML
value
Test-45 in: FileFilter_46_input.featureXML
out_type: featureXML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist: "YSFS" "STLIPPPSK(Label:13C(6)15N(2))"
id|sequence_comparison_method: exact
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_46_input.featureXML
value
Test-46 in: FileFilter_47_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|file: FileFilter_47_input_select.mzML
spectra|blackorwhitelist|similarity_threshold: 0.9
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_47_input.mzML
FileFilter_47_input_select.mzML
value
Test-47 in: FileFilter_47_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: False
peak_options|numpress|masstime: none
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: none
peak_options|numpress|float_da: none
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|file: FileFilter_47_input_select.mzML
spectra|blackorwhitelist|similarity_threshold: 0.9
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: False
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_47_input.mzML
FileFilter_47_input_select.mzML
value
Test-48 in: FileFilter_49_input.mzML
out_type: mzML
rt: :
mz: :
int: :
sort: False
peak_options|sn: 0.0
peak_options|rm_pc_charge:
peak_options|pc_mz_range: :
peak_options|pc_mz_list:
peak_options|level: 1 2 3
peak_options|sort_peaks: False
peak_options|no_chromatograms: False
peak_options|remove_chromatograms: False
peak_options|remove_empty: False
peak_options|mz_precision: 64
peak_options|int_precision: 32
peak_options|indexed_file: True
peak_options|zlib_compression: True
peak_options|numpress|masstime: linear
peak_options|numpress|lossy_mass_accuracy: -1.0
peak_options|numpress|intensity: pic
peak_options|numpress|float_da: slof
spectra|remove_zoom: False
spectra|remove_mode: None
spectra|remove_activation: None
spectra|remove_collision_energy: :
spectra|remove_isolation_window_width: :
spectra|select_zoom: False
spectra|select_mode: None
spectra|select_activation: None
spectra|select_collision_energy: :
spectra|select_isolation_window_width: :
spectra|select_polarity: None
spectra|replace_pc_charge: :
spectra|blackorwhitelist|similarity_threshold: -1.0
spectra|blackorwhitelist|rt: 0.01
spectra|blackorwhitelist|mz: 0.01
spectra|blackorwhitelist|use_ppm_tolerance: false
spectra|blackorwhitelist|blacklist: True
feature|q: :
consensus|map:
consensus|map_and: False
consensus|blackorwhitelist|blacklist: True
consensus|blackorwhitelist|maps:
consensus|blackorwhitelist|rt: 60.0
consensus|blackorwhitelist|mz: 0.01
consensus|blackorwhitelist|use_ppm_tolerance: False
f_and_c|charge: :
f_and_c|size: :
f_and_c|remove_meta:
id|remove_clashes: False
id|keep_best_score_id: False
id|sequences_whitelist:
id|sequence_comparison_method: substring
id|accessions_whitelist:
id|remove_annotated_features: False
id|remove_unannotated_features: False
id|remove_unassigned_ids: False
id|rt: 0.1
id|mz: 0.001
id|blacklist_imperfect: False
algorithm|SignalToNoise|max_intensity: -1
algorithm|SignalToNoise|auto_max_stdev_factor: 3.0
algorithm|SignalToNoise|auto_max_percentile: 95
algorithm|SignalToNoise|auto_mode: 0
algorithm|SignalToNoise|win_len: 200.0
algorithm|SignalToNoise|bin_count: 30
algorithm|SignalToNoise|min_required_elements: 10
algorithm|SignalToNoise|noise_for_empty_window: 1e+20
algorithm|SignalToNoise|write_log_messages: True
adv_opts|force: False
adv_opts|test: true
OPTIONAL_OUTPUTS: ctd_out_FLAG
name: value
name: value
FileFilter_49_input.mzML
value