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Record W4416396948 · doi:10.1016/j.aca.2025.344900

Preoperative untargeted SPME-LC/HRMS-based metabolomic profiling in cardiac surgical patients identified prognostic biomarkers for postoperative outcomes

2025· article· en· W4416396948 on OpenAlexafffund
Mariola Olkowicz, Hernando Rosales-Solano, Humara Poonawala, Angela Jerath, Marcin Wąsowicz, Janusz Pawliszyn

Bibliographic record

VenueAnalytica Chimica Acta · 2025
Typearticle
Languageen
FieldBiochemistry, Genetics and Molecular Biology
TopicMetabolomics and Mass Spectrometry Studies
Canadian institutionsSunnybrook Health Science CentreUniversity of TorontoUniversity of Waterloo
FundersUniversity of TorontoNatural Sciences and Engineering Research Council of CanadaHeart and Stroke Foundation of Canada
KeywordsProfiling (computer programming)PerioperativeMetabolite profilingMetaboliteMetabolomicsCardiac surgery

Abstract

fetched live from OpenAlex

BACKGROUND: Circulating metabolite profiles may reflect the physiological status before cardiac surgery and could contribute to predicting clinical outcome. Accordingly, metabolite levels may improve risk models as clinical models alone using known, or suspected, risk factors may have limited applicability to subtler organ-specific injury. Hence, the aim of this study was to comprehensively describe perioperative changes in metabolic profiles in cardiac surgical patients requiring cardiopulmonary bypass to find association with outcomes. RESULTS: In this work, a sequential extraction strategy using two SPME devices with different selectivity (C18/PAN- and C8-SCX/PAN-coated fibers) next to dual-mode separation (hydrophilic interaction - reversed-phase) was proposed for improving plasma metabolome coverage and data quality, and consequently facilitating discriminative biomarker discovery. This complementary methodology enhanced metabolome coverage demonstrating that patients undergoing complex open cardiac surgery (n = 22) could be efficiently distinguished from low-risk surgery patients (n = 27) based on their metabolic profiles. Metabolite profiles belonging to the high-risk patients showed higher levels of accumulation of incomplete products of fatty acid (FA) β-oxidation, bile acids, glucuronides, and lipid mediators derived from polyunsaturated FAs, along with perturbations in essential amino acid metabolism that potentially might be linked with multiple poor clinical outcomes (i.e. postoperative seizure, ischemic-thrombotic complications, death). SIGNIFICANCE: The analytical workflow, presented in this study, greatly expanded the capacity for comprehensive metabolite profiling in demanding biological matrices. With more patients undergoing complex cardiac surgery at the advanced age, this work adds to improving perioperative care through implementing metabolic solutions that may streamline recovery.

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)0.000
metaresearch head score (Gemma)0.001
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Observational · Consensus signal: none
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.001
Threshold uncertainty score0.003

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0000.001
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0010.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0010.000

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 head0.008
GPT teacher head0.276
Teacher spread0.268 · 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 designObservational
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

Citations0
Published2025
Admission routes2
Has abstractyes

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