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Record W2764166773 · doi:10.1194/jlr.m079012

Harmonizing lipidomics: NIST interlaboratory comparison exercise for lipidomics using SRM 1950–Metabolites in Frozen Human Plasma

2017· article· en· W2764166773 on OpenAlexafffund
John A. Bowden, N. Alan Heckert, Candice Z. Ulmer, Christina M. Jones, Jeremy P. Koelmel, Laila Abdullah, Linda Ahonen, Yazen Alnouti, Aaron M. Armando, John M. Asara, Takeshi Bamba, John R. Barr, Jonas Bergquist, Christoph H. Borchers, Joost Brandsma, Susanne B. Breitkopf, Tomáš Čajka, Amaury Cazenave‐Gassiot, Antonio Checa, Michelle Cinel, Romain A. Colas, Serge Cremers, Edward A. Dennis, Alexander Fauland, Oliver Fiehn, Michael S. Gardner, Timothy J. Garrett, Katherine Gotlinger, Jun Han, Yingying Huang, Aveline Huipeng Neo, Tuulia Hyötyläinen, Yoshihiro Izumi, Hongfeng Jiang, Houli Jiang, Jiang Jiang, Maureen Kachman, Reiko Kiyonami, Kristaps Klavins, Christian Klose, Harald Köfeler, Johan Kolmert, Therese Koal, Grielof Koster, Zsuzsanna Kuklenyik, Irwin J. Kurland, Michael Leadley, Karen Lin, Krishna Rao Maddipati, Danielle McDougall, Peter J. Meikle, Natalie A. Mellett, Cian Monnin, M. Arthur Moseley, Renu Nandakumar, Matej Orešič, R. E. Patterson, David A. Peake, Jason S. Pierce, Martin Post, Anthony D. Postle, Rebecca S. Pugh, Yunping Qiu, Oswald Quehenberger, Parsram Ramrup, Jon C. Rees, Barbara Rembiesa, Dénis Reynaud, Mary R. Roth, Susanne Sales, Kai Schuhmann, Michal L. Schwartzman, Charles N. Serhan, Andrej Shevchenko, Stephen E. Somerville, Lisa St. John‐Williams, Michał A. Surma, Hiroaki Takeda, Rhishikesh Thakare, J. Will Thompson, Federico Torta, Alexander Triebl, Martin Trötzmüller, S. J. Kumari A. Ubhayasekera, Dajana Vuckovic, Jacquelyn M. Weir, Ruth Welti, Markus R. Wenk, Craig E. Wheelock, Libin Yao, Min Yuan, Xueqing Zhao, Sen-Lin Zhou

Bibliographic record

VenueJournal of Lipid Research · 2017
Typearticle
Languageen
FieldBiochemistry, Genetics and Molecular Biology
TopicMetabolomics and Mass Spectrometry Studies
Canadian institutionsConcordia UniversityUniversity of VictoriaMcGill UniversityHospital for Sick ChildrenGenome British ColumbiaJewish General Hospital
FundersAdvanced Low Carbon Technology Research and Development ProgramCore Research for Evolutional Science and TechnologyNational Center for Advancing Translational SciencesOffice of Experimental Program to Stimulate Competitive ResearchNational Center for Research ResourcesNational Institute of Diabetes and Digestive and Kidney DiseasesNational Heart, Lung, and Blood InstituteNatural Sciences and Engineering Research Council of CanadaCanadian Institutes of Health ResearchNational Institute of Standards and TechnologyNational Research Foundation SingaporeNational Institute for Health Research Southampton Biomedical Research CentreDirectorate for Biological SciencesNational Institutes of HealthNational Institute of General Medical SciencesWarren Y. Soper Charitable TrustNational Cancer InstituteGenome AlbertaJapan Science and Technology AgencyGeorgia Clinical and Translational Science AllianceVetenskapsrådetHjärt-LungfondenAustrian Science FundNational University of SingaporeNational Research FoundationLeading Edge Endowment FundMcGill UniversityJapan Agency for Medical Research and DevelopmentGenome British ColumbiaFondation De Famille Alvin SegalSteno Diabetes Center CopenhagenKansas IDeA Network of Biomedical Research ExcellenceJewish General HospitalNational Institute for Health and Care ResearchGenome CanadaNational Science Foundation
KeywordsLipidomicsNISTWorkflowChemistryComputer scienceBiochemistryDatabase

Abstract

fetched live from OpenAlex

As the lipidomics field continues to advance, self-evaluation within the community is critical. Here, we performed an interlaboratory comparison exercise for lipidomics using Standard Reference Material (SRM) 1950-Metabolites in Frozen Human Plasma, a commercially available reference material. The interlaboratory study comprised 31 diverse laboratories, with each laboratory using a different lipidomics workflow. A total of 1,527 unique lipids were measured across all laboratories and consensus location estimates and associated uncertainties were determined for 339 of these lipids measured at the sum composition level by five or more participating laboratories. These evaluated lipids detected in SRM 1950 serve as community-wide benchmarks for intra- and interlaboratory quality control and method validation. These analyses were performed using nonstandardized laboratory-independent workflows. The consensus locations were also compared with a previous examination of SRM 1950 by the LIPID MAPS consortium. While the central theme of the interlaboratory study was to provide values to help harmonize lipids, lipid mediators, and precursor measurements across the community, it was also initiated to stimulate a discussion regarding areas in need of improvement.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame machine prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.

metaresearch head score (Codex)0.072
metaresearch head score (Gemma)0.047
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.072
Threshold uncertainty score0.381

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0720.047
Meta-epidemiology (narrow)0.0010.001
Meta-epidemiology (broad)0.0010.002
Bibliometrics0.0040.003
Science and technology studies0.0040.002
Scholarly communication0.0030.001
Open science0.0020.004
Research integrity0.0020.001
Insufficient payload (model declined to judge)0.0010.001

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.201
GPT teacher head0.445
Teacher spread0.244 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one source (direct Gemma or distilled Codex), not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations411
Published2017
Admission routes2
Has abstractyes

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