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pmid:26545397

PRIDE Inspector Toolsuite: Moving Toward a Universal Visualization Tool for Proteomics Data Standard Formats and Quality Assessment of ProteomeXchange Datasets.

Yasset Perez-Riverol · Qing-Wei Xu · Rui Wang · Julian Uszkoreit · Johannes Griss · Aniel Sanchez · Florian Reisinger · Attila Csordas · Tobias Ternent · Noemi Del-Toro · Jose A Dianes · Martin Eisenacher · Henning Hermjakob · Juan Antonio Vizcaíno

Molecular & cellular proteomics : MCP · 2016 doi:10.1074/mcp.O115.050229

Paper

complete

Experiment

partial

Data

partial

Analysis

partial

Execution

absent

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Record details sci_version · id · kind · revision · content_hash · schema · created_at · updated_at · generator
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pmid:26545397
kind
science-record
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created_at
2026-11-01T15:40:13Z
updated_at
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paper object · 10 fields
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title
PRIDE Inspector Toolsuite: Moving Toward a Universal Visualization Tool for Proteomics Data Standard Formats and Quality Assessment of ProteomeXchange Datasets.
doi
10.1074/mcp.O115.050229
pmid
26545397
authors array · 14 items
[0]
Yasset Perez-Riverol
[1]
Qing-Wei Xu
[2]
Rui Wang
[3]
Julian Uszkoreit
[4]
Johannes Griss
[5]
Aniel Sanchez
[6]
Florian Reisinger
[7]
Attila Csordas
[8]
Tobias Ternent
[9]
Noemi Del-Toro
[10]
Jose A Dianes
[11]
Martin Eisenacher
[12]
Henning Hermjakob
[13]
Juan Antonio Vizcaíno
journal
Molecular & cellular proteomics : MCP
year
2016
abstract
The original PRIDE Inspector tool was developed as an open source standalone tool to enable the visualization and validation of mass-spectrometry (MS)-based proteomics data before data submission or already publicly available in the Proteomics Identifications (PRIDE) database. The initial implementation of the tool focused on visualizing PRIDE data by supporting the PRIDE XML format and a direct access to private (password protected) and public experiments in PRIDE.The ProteomeXchange (PX) Consortium has been set up to enable a better integration of existing public proteomics repositories, maximizing its benefit to the scientific community through the implementation of standard submission and dissemination pipelines. Within the Consortium, PRIDE is focused on supporting submissions of tandem MS data. The increasing use and popularity of the new Proteomics Standards Initiative (PSI) data standards such as mzIdentML and mzTab, and the diversity of workflows supported by the PX resources, prompted us to design and implement a new suite of algorithms and libraries that would build upon the success of the original PRIDE Inspector and would enable users to visualize and validate PX "complete" submissions. The PRIDE Inspector Toolsuite supports the handling and visualization of different experimental output files, ranging from spectra (mzML, mzXML, and the most popular peak lists formats) and peptide and protein identification results (mzIdentML, PRIDE XML, mzTab) to quantification data (mzTab, PRIDE XML), using a modular and extensible set of open-source, cross-platform libraries. We believe that the PRIDE Inspector Toolsuite represents a milestone in the visualization and quality assessment of proteomics data. It is freely available at http://github.com/PRIDE-Toolsuite/.
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The cumulative binomial probability previously used in other algorithms (22, 23) is given to the generated fragment ion annotations, representing the probability of randomly matching at least the given number of fragment ions to the tandem mass spectrum, which is calculated by using the total number of fragment ions for the given peptide (N), the number of ions matched to the spectrum (n), and the probability of matching a peak (p).
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sections[12] "MS/MS Spectrum Automatic Fragmentation Annotation Algorithm" paragraph 4
quote
The cumulative binomial probability previously used in other algorithms (22, 23) is given to the generated fragment ion annotations, representing the probability of randomly matching at least the given number of fragment ions to the tandem mass spectrum, which is calculated by using the total number of fragment ions for the given peptide (N), the number of ions matched to the spectrum (n), and the probability of matching a peak (p).
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Example mzIdentML files (including the corresponding mass spectra files) coming from a variety of sources to test the functionality of the software are available at https://github.com/PRIDE-Toolsuite/inspector-example-files.
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sections[18] "Support for New File Formats" paragraph 4
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Example mzIdentML files (including the corresponding mass spectra files) coming from a variety of sources to test the functionality of the software are available at https://github.com/PRIDE-Toolsuite/inspector-example-files.
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the published estimate and its evidence
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the replicated result and its comparison
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Organization of the PRIDE Inspector Toolsuite modules
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Design and Implementation
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Table I
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Organization of the PRIDE Inspector Toolsuite modules
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Library or GUI component
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PRIDE-Utilities
[1]
PRIDE Utilities
[2]
It contains functionalities shared by different PRIDE Toolsuite libraries such as controlled vocabulary data structures and prediction algorithms of peptide/protein properties
[3]
https://github.com/PRIDE-Utilities/pride-utilities
[2] array · 3 items
[0]
PRIDE Data Object Model (ms-data-core-api)
[1]
Data model representation of MS proteomics data with special emphasis in metadata information
[2]
https://github.com/PRIDE-Utilities/ms-data-core-api
[3] array · 3 items
[0]
PRIDE Protein Inference
[1]
It implements a set of protein inference algorithms, coupled with the ms-data-core-api data model
[2]
https://github.com/PRIDE-Utilities/pride-protein-inference
[4] array · 3 items
[0]
PRIDE Modification
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It retrieves the information from the main protein modification controlled vocabularies and/or ontologies (Unimod and PSI-MOD)
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https://github.com/PRIDE-Utilities/pride-mod
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[0]
PRIDE-Toolsuite
[1]
PRIDE Inspector Quality Chart
[2]
Chart library developed using Java Swing and JFreeChart, which provides a way to assess the quality of MS experiments
[3]
https://github.com/PRIDE-Toolsuite/inspector-quality-chart
[6] array · 3 items
[0]
PRIDE Spectrum Browser
[1]
Java Swing library to visualize and annotate MS/MS spectra, chromatograms and fragment annotations
[2]
https://github.com/PRIDE-Toolsuite/inspector-mzgraph-browser
[7] array · 3 items
[0]
PRIDE Inspector Tool
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Desktop application tool
[2]
https://github.com/PRIDE-Toolsuite/pride-inspector
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[0]
PRIDE Inspector Toolsuite examples
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Set of example files from different sources (mzIdentML, PRIDE XML, mzTab, and mass spectra files) that can be used for testing purposes
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https://github.com/PRIDE-Toolsuite/inspector-example-files
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section[11]/table-wrap[1]#TI
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List of supported file formats in PRIDE Inspector Toolsuite, including the list of the exporters explicitly tested and supported (by September 2015)
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Support for New File Formats
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Table II
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List of supported file formats in PRIDE Inspector Toolsuite, including the list of the exporters explicitly tested and supported (by September 2015)
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Mass spectra file formats
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mzML
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ProteoWizard and others
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Mass Spectrum
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mzData
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Summary Charts
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jmzReader
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Yes
[2]
Mass Spectrum, Summary Charts
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jmzReader
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[0]
Identification file formats
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PRIDE XML
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PRIDE Converter 2
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[4]
[5]
pride-jaxb
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ProteinPilot
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ProteoAnnotator
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mzIdentML
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Mass Spectrum (if mass spectra file is associated)
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jmzIdentML
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PEAKS
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Summary Charts
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IsoQuant
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Pep2pro
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jmzTab converter
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IsoQuant
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Mass Spectrum (if mass spectra file is associated)
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Summary Charts
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Metadata
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jmzTab
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Protein
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Peptide
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PRIDE XML
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PRIDE Converter 2
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No
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Mass Spectrum (if peak list file is associated)
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pride-jaxb
[25] array · 1 item
[0]
Quantification
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Summary Charts
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section[18]/table-wrap[1]#TII
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quote
The cumulative binomial probability previously used in other algorithms (22, 23) is given to the generated fragment ion annotations, representing the probability of randomly matching at least the given number of fragment ions to the tandem mass spectrum, which is calculated by using the total number of fragment ions for the given peptide (N), the number of ions matched to the spectrum (n), and the probability of matching a peak (p).
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meta_analysis
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Automated Assays Laravel application and simulated adapters
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Example mzIdentML files (including the corresponding mass spectra files) coming from a variety of sources to test the functionality of the software are available at https://github.com/PRIDE-Toolsuite/inspector-example-files.
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Complete file
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The initial implementation of the tool focused on visualizing PRIDE data by supporting the PRIDE XML format and a direct access to private (password protected) and public experiments in PRIDE.The ProteomeXchange (PX) Consortium has been set up to enable a better integration of existing public proteomics repositories, maximizing its benefit to the scientific community through the implementation of standard submission and dissemination pipelines. Within the Consortium, PRIDE is focused on supporting submissions of tandem MS data. The increasing use and popularity of the new Proteomics Standards Initiative (PSI) data standards such as mzIdentML and mzTab, and the diversity of workflows supported by the PX resources, prompted us to design and implement a new suite of algorithms and libraries that would build upon the success of the original PRIDE Inspector and would enable users to visualize and validate PX \"complete\" submissions. The PRIDE Inspector Toolsuite supports the handling and visualization of different experimental output files, ranging from spectra (mzML, mzXML, and the most popular peak lists formats) and peptide and protein identification results (mzIdentML, PRIDE XML, mzTab) to quantification data (mzTab, PRIDE XML), using a modular and extensible set of open-source, cross-platform libraries. We believe that the PRIDE Inspector Toolsuite represents a milestone in the visualization and quality assessment of proteomics data. 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