Learn R Programming

IDSL.FSA (version 1.2)

Fragmentation Spectra Analysis (FSA)

Description

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 .

Copy Link

Version

Install

install.packages('IDSL.FSA')

Monthly Downloads

161

Version

1.2

License

MIT + file LICENSE

Issues

Pull Requests

Stars

Forks

Maintainer

Dinesh Barupal

Last Published

June 29th, 2023

Functions in IDSL.FSA (1.2)

FSA_xlsxAnalyzer

FSA xlsx Analyzer
FSdb_subsetter

FSdb subsetter
UFSA_ionization_pathway_deconvoluter

Ionization Pathway Deconvoluter
mgf2msp

MGF to MSP
plotFSdb2SpectraCore

plot spectra from FSdb core
mspPosNegSplitter

MSP Pos/Neg Splitter
FSdb2msp

Fragmentation Spectra DataBase (FSDB) to MSP
FSdb2precursorType

Precursor Types from Fragmentation Spectra DataBase (FSDB)
FSdb_file_generator

FSdb file generator
fragmentation_spectra_annotator

Fragmentation Spectra Annotator
msp2FSdb

msp to Fragmentation Spectra DataBase (FSDB)
msp2TrainingMatrix

msp to Fragmentation Spectra DataBase (FSDB)
UFSA_precursorType_corrector

UFA Precursor Type Corrector
spectra_1A1B_mixer

Mixer 1:1 spectra A and B
spectra_integrator

Spectra Integrator
xlsx2msp

xlsx to MSP
spectral_entropy_similarity_score

Spectral Entropy Calculator
UFSA_element_sorter

Element Sorter
stackedSpectra

Example for a stacked spectra
spectra_ion_filter

Spectra Ion Filter
spectral_entropy_calculator

Spectral Entropy Calculator
UFSA_hill_molecular_formula_printer

Print Hill Molecular Formula
UFSA_formula_vector_generator

Molecular Formula Vector Generator
FSA_R.aggregate

aggregate function for IDSL.FSA
FSA_msp2Cytoscape

FSA Cytoscape Files Generator
FSA_SpectraSimilarity_xlsxAnalyzer

FSA SpectraSimilarity xlsx Analyzer
FSA_dir.create

FSA_dir.create
FSA_locate_regex

FSA Locate regex
FSA_logRecorder

FSA logRecorder
FSA_aggregate

aggregation method for FSA
FSA_loadRdata

FSA loadRdata
FSA_annotation_text_repel

FSA annotation text repel
FSA_message

FSA message
FSA_workflow

FSA workflow
FSA_spectra_marker_generator

FSA Spectra Marker Generator
FSA_plotFSdb2Spectra

plot FSdb to Spectra
FSA_uniqueMSPblockTagger

FSA Unique MSP Block Tagger
FSdb2PeakXcolSubsetter

FSdb2PeakXcolSubsetter
FSA_FSdb_xlsxAnalyzer

FSA FSdb xlsx Analyzer
FSA_uniqueMSPblockTaggerUntargeted

FSA_uniqueMSPblockTaggerUntargeted
FSA_msp_annotator

FSA msp annotator