LipidCCS: Prediction of Collision Cross-Section Values for Lipids with High Precision to Support Ion Mobility-Mass Spectrometry-Based Lipidomics

Analytical Chemistry

Volumn 89, Issue 17, 2017, Pages 9559-9566

  Zhou, Zhiwei ^a,b   Tu, Jia ^a,b   Xiong, Xin ^a   Shen, Xiaotao ^a,b   Zhu, Zheng Jiang ^a  

^a SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY   (China)

^b UNIVERSITY OF CHINESE ACADEMY OF SCIENCES   (China)

Author keywords

[No Author keywords available]

Indexed keywords

INSTRUMENT ERRORS; ION MOBILITY SPECTROMETERS; LEARNING ALGORITHMS; LEARNING SYSTEMS; LIPIDS; MASS SPECTROMETRY; SEARCH ENGINES; SPECTROMETRY; WEB SERVICES;

COLLISION CROSS SECTIONS; DATABASE SEARCHES; FALSE-POSITIVE IDENTIFICATIONS; ION MOBILITY-MASS SPECTROMETRY; MOLECULAR DESCRIPTORS; PREDICTION PRECISION; STRUCTURAL SIMILARITY; STRUCTURE DIFFERENCE;

FORECASTING;

LIPID;

CHEMISTRY; FACTUAL DATABASE; ION MOBILITY SPECTROMETRY; MASS SPECTROMETRY; METABOLOMICS; MOLECULAR WEIGHT; PROCEDURES; REPRODUCIBILITY;

DATABASES, FACTUAL; ION MOBILITY SPECTROMETRY; LIPIDS; MASS SPECTROMETRY; METABOLOMICS; MOLECULAR WEIGHT; REPRODUCIBILITY OF RESULTS;

EID: 85028923771     PISSN: 00032700     EISSN: 15206882     Source Type: Journal    
DOI: 10.1021/acs.analchem.7b02625     Document Type: Article

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