LipidMatch Normalizer
LipidMatch Normalizer normalizes LC-MS/MS lipidomics feature intensities using internal-standard-based assignments to enable standardized quantification across samples.
Key Features:
- Internal Standard Assignment: Employs a systematic ranking system (1–3) to assign internal standards to target lipids, where rank 1 indicates an exact match in lipid class and adduct and rank 3 indicates no match.
- Retention Time Optimization: When multiple internal standards exist for a lipid class, prioritizes standards with retention times closest to the target analyte.
- Lipid Class Representation Flexibility: Allows specification of which lipid classes an internal standard represents, enabling semi-quantitative assessment of related species (e.g., using phosphatidylcholine as a proxy for ether-linked phosphatidylcholines).
- Compatibility with Open Source Workflows: Designed to operate within open-source lipidomics workflows and to support feature finding, annotation, and quantification in LC-MS/MS studies.
- Impact Assessment on Data Processing Strategies: Evaluates how data-processing choices—peak height versus peak area, adduct selection, and ionization polarity (negative vs. positive)—affect final lipid concentrations.
Scientific Applications:
- Plasma lipid quantification: Standardizes relative quantitation in complex biological matrices such as NIST SRM 1950 human plasma.
- Clinical and translational lipidomics: Supports clinical diagnostics and studies of health and disease mechanisms by enabling more consistent lipid quantification.
- Method development and optimization: Facilitates assessment and optimization of data-processing strategies to improve quantitative outcomes.
Methodology:
Operates independently of specific lipid identification or feature-finding software; has been used with LipidMatch and MZmine to annotate and quantify lipids in NIST SRM 1950 human plasma samples.
Topics
Details
- License:
- GPL-3.0
- Maturity:
- Mature
- Cost:
- Free of charge
- Tool Type:
- command-line tool
- Operating Systems:
- Linux, Windows, Mac
- Programming Languages:
- R
- Added:
- 6/20/2019
- Last Updated:
- 6/16/2020
Operations
Publications
Koelmel JP, Cochran JA, Ulmer CZ, Levy AJ, Patterson RE, Olsen BC, Yost RA, Bowden JA, Garrett TJ. Software tool for internal standard based normalization of lipids, and effect of data-processing strategies on resulting values. BMC Bioinformatics. 2019;20(1). doi:10.1186/s12859-019-2803-8. PMID:31035918. PMCID:PMC6489209.
PMID: 31035918
PMCID: PMC6489209
Funding: - National Institute of Diabetes and Digestive and Kidney Diseases: U24 DK097209
Documentation
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R
Relation: uses