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Record W4377013443 · doi:10.1021/acs.analchem.3c00093

Second-Dimension Temperature Programming System for Comprehensive Two-Dimensional Gas Chromatography. Part 2: Technical Improvements and Compatibility with Flow Modulation and Time-of-Flight Mass Spectrometry

2023· article· en· W4377013443 on OpenAlexafffund
H. Chow, Tadeusz Górecki

Bibliographic record

VenueAnalytical Chemistry · 2023
Typearticle
Languageen
FieldChemistry
TopicAnalytical Chemistry and Chromatography
Canadian institutionsUniversity of Waterloo
FundersNatural Sciences and Engineering Research Council of Canada
KeywordsChemistryReproducibilityTwo-dimensional gasAnalytical Chemistry (journal)Mass spectrometryChromatographyCompatibility (geochemistry)Gas chromatographyGas chromatography–mass spectrometryRetention timeTwo-dimensional chromatographyModulation (music)Chemical engineering

Abstract

fetched live from OpenAlex

The second-dimension ( 2 D) temperature programming system ( 2 DTPS) for comprehensive two-dimensional gas chromatography (GC × GC) described in Part 1 was updated and tested with the time-of-flight mass spectrometer (TOFMS) and flow modulator. Addition of a real-time clock and remote port allowed the 2 DTPS to be a truly standalone system to be used with any GC × GC instrument. GC × GC reproducibility with the 2 DTPS was tested with thermal and flow modulation, coupled with the TOFMS and/or FID to demonstrate compatibility with all typical GC × GC setups. An improvement in the match factor, reverse match factor, and signal-to-noise ratio was found when performing 2 D temperature programming. Within-day and day-to-day reproducibility of the 2 DTPS for the 1 D retention time (≤0.04 and ≤0.05%), 2 D retention time (≤0.36 and ≤0.52%), and peak area (≤2.47 and ≤3.37%) were acceptable, while providing flexibility in 2 D optimization and improved peak capacity.

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)0.003
metaresearch head score (Gemma)0.004
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: Methods · Consensus signal: Methods
Teacher disagreement score0.012
Threshold uncertainty score0.040

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0030.004
Meta-epidemiology (narrow)0.0030.002
Meta-epidemiology (broad)0.0010.001
Bibliometrics0.0020.001
Science and technology studies0.0010.001
Scholarly communication0.0010.002
Open science0.0020.002
Research integrity0.0020.003
Insufficient payload (model declined to judge)0.0120.008

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 head0.010
GPT teacher head0.241
Teacher spread0.231 · 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
GenreMethods

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

Citations2
Published2023
Admission routes2
Has abstractyes

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