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Record W1860362055 · doi:10.1002/9780470027318.a1119

Nuclear Magnetic Resonance Spectroscopy for the Detection and Quantification of Abused Drugs

2000· other· en· W1860362055 on OpenAlex
Brian A. Dawson

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
TopicMetabolomics and Mass Spectrometry Studies
Canadian institutionsHealth Canada
Fundersnot available
KeywordsNuclear magnetic resonance spectroscopyMass spectrometryDrugs of abuseChemistryProfiling (computer programming)Analytical Chemistry (journal)Nuclear magnetic resonanceMaterials scienceChromatographyDrugComputer sciencePhysicsOrganic chemistryMedicine

Abstract

fetched live from OpenAlex

Abstract Nuclear magnetic resonance (NMR) spectroscopy provides the forensic analyst with an extremely powerful tool for the detection and quantification of abused drugs. A whole range of one‐dimensional (1‐D) and two‐dimensional (2‐D) NMR techniques is available for performing the required analyses. These NMR methods may be used for routine purposes, such as to confirm the identity of a drug or quantify the amount of illicit substance present in a police exhibit. However, the area where NMR stands out as an analytical tool is in the identification of unknown compounds, such as “designer drugs”. NMR is also used in police intelligence work, as it can provide clues to the synthetic route used to prepare the drug. This is done by impurity profiling or by determining the drug's optical purity. Although NMR has been used for many years to analyze abused drugs, even the most modern spectrometers lack the sensitivity obtainable by other techniques such as mass spectrometry (MS) or high‐performance liquid chromatography (HPLC). However, NMR is a nondestructive technique which provides essential structural information which cannot be obtained from these other methods. NMR also has the distinct advantage of not requiring reference standards for the identification of unknowns.

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.

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 categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Not applicable · Consensus signal: none
GenreCandidate signal: Other · Consensus signal: Other
Teacher disagreement score0.743
Threshold uncertainty score0.589

Codex and Gemma teacher scores by category

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

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 head0.006
GPT teacher head0.234
Teacher spread0.228 · 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