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LipidLynxX

A data transfer hub to support integration of large scale lipidomics datasets

Description

LipidLynxX was developed to provide efficient and accurate data transfer between analytical lipidomics datasets and data integration tools. It consists of three main modules supporting the conversion of diverse lipid annotations deriving from experimental lipidomics to unified identifier of user choice (Converter), cross-matching and equalizing lipid identifications obtained at different levels of structural confirmation (Equalizer), and mapping of annotated lipids to identifiers in a collection of databases and knowledge bases such as LIPID MAPS, SwissLipids, KEGG, Rhea, UniprotKB etc. that can be connected to ontology, pathway and network analysis workflows (Linker). LipidLynxX has built-in support to read and generate abbreviation of lipids while keeping the information e.g. modifications types and positions to perform hierarchical comparison. Based on this, LipidLynxX can reduce the over reporting of lipid identifiers and obtain associated identifiers from multiple databases. LipidLynxX provides a high-thoughput solution to format large-scale lipidomics identifiers and assist data integration workflows.

Technical Information

Programming languages:
Python,
JavaScript
Platforms:
Windows,
Linux,
MacOS
Output formats:
HTML,
CSV,
Excel
Input formats:
Text,
CSV,
Excel,
REST service
Desktop client:
No
CLI:
Yes
GUI:
Yes
License:
GPL

Tasks

7.1) Lipid annotations and ID converters
Other features:
Equalizer: cross-match and equalize lipid identifications obtained from various sources at different levels of structural confirmation.,
Linker: cross link lipid identifiers to the identifiers from a collection of databases and knowledge bases used by ontology, pathway and network analysis tools.
Link to the external databases:
LIPID MAPS LMSD,
SwissLipids,
HMDB,
LION/Web,
ChEBI,
PubChem,
KEGG,
Rhea,
Uniprot KB
Output annotations or ids:
Shorthand notation (according to PMID: 33037133),
BioPAN,
LipidLynxX
Input annotations or ids:
HMDB,
LIPID MAPS LMSD,
LIPID MAPS COMP_DB,
LipidHome,
RefMet,
SwissLipids,
ALEX123 lipid calculator,
Greazy,
LDA 2,
LipidBlast,
LipidCreator,
LipiDex,
LipidFrag,
LipidHunter,
LipidMatch,
LipidPro,
LipidSearch,
Lipostar,
LIQUID,
LPPtiger,
MetFrag,
MS-DIAL,
MZmine2,
Shorthand notation (according to PMID: 33037133),
Common name
Supported levels of structural annotations:
Species,
Molecular species,
Structure defined levels
Normenclature:
LIPID MAPS classification, Nomenclature, and Shorthand notation (PMID: 33037133)
Supported lipid classes:
5 out of 8 LIPID MAPS classes