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Record W2116614333 · doi:10.1002/9780470027318.a1612

<scp>F</scp> ourier Transform Infrared Spectroscopy in Peptide and Protein Analysis

2000· other· en· W2116614333 on OpenAlex
Heinz Fabian, Christian Schultz

Why this work is in the frame

A frame that forgets how it found something cannot be audited. These are the routes that admitted this work.

affAt least one author lists a Canadian institution in the pinned OpenAlex snapshot.

Bibliographic record

VenueEncyclopedia of Analytical Chemistry · 2000
Typeother
Languageen
FieldBiochemistry, Genetics and Molecular Biology
TopicSpectroscopy Techniques in Biomedical and Chemical Research
Canadian institutionsNational Research Council Institute for Biodiagnostics
Fundersnot available
KeywordsFourier transform infrared spectroscopyInfrared spectroscopySpectroscopyInfraredRaman spectroscopyChemistryAnalytical Chemistry (journal)Fourier transformMolecular vibrationAbsorption (acoustics)MoleculeAbsorption spectroscopyFourier transform spectroscopyMaterials scienceOpticsMathematicsPhysicsChromatographyOrganic chemistry

Abstract

fetched live from OpenAlex

Abstract Infrared (IR) spectroscopy is one of the two forms of vibrational spectroscopy, the other being Raman spectroscopy. IR spectroscopy measures absorptions of vibrating molecules and yields information about molecular structures and structural interactions. The development of computerized Fourier transform infrared (FTIR) techniques has opened up new dimensions in biological IR spectroscopy owing to the increase in achievable signal‐to‐noise ratios, wavenumber accuracy, and data aquisition rates, and the ability to perform measurements with strongly absorbing samples. High‐quality FTIR spectra can be obtained with relative ease and rapidly with very small amounts of sample in a variety of environments. Measurements of proteins in aqueous solution are almost routine now, and can be performed under equilibrium and nonequilibrium conditions. There are many IR absorption bands characteristic of peptide groups and amino acid side‐chain groups from which information on protein structures can be obtained. The information provided by FTIR spectroscopy may be a global one or highly specific for a single vibrating chemical group. In some cases, the usefulness of the method is limited by difficulties in extracting the structural information contained in the IR absorption bands.

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.

Direct model labels (unvalidated)

Per-model category and study-design labels from the labeling rounds. They are machine output, unvalidated, and the disagreement between models ships as data. No study design here is MEDLINE-validated yet.

Model armCategoriesStudy designConfidence
gemmano category
Domain: not available · Genre: Other
About the Canadian research system: no · About a Canadian topic: no
Not applicablelow
gptno category
Domain: not available · Genre: Other
About the Canadian research system: no · About a Canadian topic: no
Not applicablemedium
models agreeAgreement compares identical category sets and study designs across arms.

Full frame distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow), Insufficient payload (model declined to judge)
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Not applicable · Consensus signal: Not applicable
GenreCandidate signal: Other · Consensus signal: Other
Teacher disagreement score0.037
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0010.000
Bibliometrics0.0000.001
Science and technology studies0.0000.001
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0010.001
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 head0.004
GPT teacher head0.269
Teacher spread0.264 · 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