IDSL.FSA

Fragmentation Spectra Analysis (FSA)

Dinesh Kumar Barupal, Sadjad Fakouri Fakouri-Baygi

Last update: 29 June 2023

Copyright license: MIT license, File License

Software version identifier: 1.0, 1.1, 1.2

The 'IDSL.FSA' package was designed to annotate standard .msp (mass spectra format) and .mgf (Mascot generic format) files using mass spectral entropy similarity, dot product (cosine) similarity, and normalized Euclidean mass error (NEME) followed by intelligent pre-filtering steps for rapid spectra searches. 'IDSL.FSA' also provides a number of modules to convert and manipulate .msp and .mgf files. The 'IDSL.FSA' workflow was integrated in the 'IDSL.CSA' and 'IDSL.NPA' packages introduced in <doi:10.1021/acs.analchem.3c00376>.

Cites work

IDSL.CSA: Composite Spectra Analysis for Chemical Annotation of Untargeted Metabolomics Datasets

Cited In (2)

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