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Record W2018934996 · doi:10.1021/op900047r

Preparation and Characterization of Theophylline−Nicotinamide Cocrystal

2009· article· en· W2018934996 on OpenAlex

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

VenueOrganic Process Research & Development · 2009
Typearticle
Languageen
FieldChemistry
TopicCrystallography and molecular interactions
Canadian institutionsWestern University
Fundersnot available
KeywordsCocrystalDifferential scanning calorimetryNicotinamideTheophyllineSolubilityChemistryThermogravimetric analysisPowder diffractionNuclear chemistryThermal analysisAnhydrousOrganic chemistryCrystallographyHydrogen bondMoleculeThermal

Abstract

fetched live from OpenAlex

Cocrystals have been increasingly recognized as an attractive alternative for solid forms of drug products. In this work, nicotinamide (NCT) was employed as a cocrystal former with the active pharmaceutical ingredient theophylline (TP). The theophylline−nicotinamide cocrystal (hereafter TP-NCT cocrystal) was prepared by solid-state grinding and slow evaporation from ethanol, and was characterized by differential scanning calorimetry (DSC), thermogravimetric analysis (TGA), hot-stage optical microscopy (HSM), Raman spectroscopy, and powder X-ray diffraction (PXRD) techniques. Pharmaceutically relevant properties such as powder dissolution rate, solubility and dynamic vapour sorption (DVS) of the TP-NCT cocrystal were evaluated. The results show that, the TP-NCT cocrystal, obtained in a 1:1 molar ratio of theophylline and nicotinamide, possesses unique thermal, spectroscopic, and X-ray diffraction properties. In addition, the solubility and hygroscopicity of the TP-NCT cocrystal were considerably higher than those of anhydrous theophylline.

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: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.009
Threshold uncertainty score0.404

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 head0.016
GPT teacher head0.330
Teacher spread0.314 · 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