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awesome-mass-spectral-libraries


https://github.com/merlin-ms/awesome-mass-spectral-libraries

Last synced: 19 days ago
JSON representation

  • Spectral Quality Assessment

  • Specifications

  • Spectral Libraries

  • Compound Annotation

    • Commercial

      • mzmine
      • FASST / fastMASST
      • GNPS2 - apps, nextflow workflows, spectral library matching, molecular networking
      • GNPS2 - apps, nextflow workflows, spectral library matching, molecular networking

  • Spectral Library Generation

    • Commercial

      • RMassBank - scripts/): Generate spectral libraries, requires specific data acquisition method
      • MSMS-Chooser - Automatically select MS/MS from LC standard runs and generate GNPS libraries

  • Handling of Spectral Libraries

    • Commercial

      • RepoRT - 023-02143-z)): Retention time database
Programming Languages
Java 1
Categories
Spectral Libraries 5 Compound Annotation 4 Spectral Library Generation 2 Specifications 1 Handling of Spectral Libraries 1 Spectral Quality Assessment 1 Other Related Resources 1
Sub Categories
Commercial 11 Public (Open) 3