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Record W2039205341 · doi:10.1039/c2fo00007e

Symmetry, chirality and crystalline tendency: the polymorphism of triacylglycerols

2012· article· en· W2039205341 on OpenAlexaff
R. John Craven, Robert W. Lencki

Bibliographic record

VenueFood & Function · 2012
Typearticle
Languageen
FieldAgricultural and Biological Sciences
TopicFood Chemistry and Fat Analysis
Canadian institutionsUniversity of Guelph
Fundersnot available
KeywordsChirality (physics)Polymorphism (computer science)GeneticsPhysicsBiologyGeneSpontaneous symmetry breakingSymmetry breakingAlleleExplicit symmetry breakingParticle physics

Abstract

fetched live from OpenAlex

The physical properties of foods containing fat are often dependent on the polymorphism of the constituent triacylglycerols (TAG). This is illustrated by the favourable physical and sensory properties associated with the β' form for margarine and butter and the β(V) form for chocolate. Recent investigations have revealed that the stereochemistry of TAG molecules has a profound influence on their polymorphism. For instance, a pure enantiomer of TAG (sn-10:0-10:0-16:0) was β'-tending while the corresponding racemic mixture (rac-10:0-10:0-16:0) was β-tending. In addition, the binary phase diagram for mixtures of the two enantiomers, sn-10:0-10:0-16:0 and sn-16:0-10:0-10:0, showed the formation of a eutectic (metastable β'-form conglomerate) and a molecular compound (stable β-form racemic compound). At heart, these differences in polymorph and crystalline tendency stem from differences in the stereochemistry of the unit cell -i.e. both enantiomers in the β unit cell, one enantiomer in the β' unit cell. Information on the relative stereochemical arrangement of molecules within the unit cell is also available from the crystallographic space group. This information (determined by X-ray diffraction) is available for a number of β- and β'-tending, chiral and achiral TAG systems. Like crystalline tendency (discussed previously), space group data indicates that the unit cell for TAG in the β' polymorph contains only one stereoisomer whereas the unit cell for TAG in the β polymorph contains both stereoisomers (conformers in achiral and enantiomers in chiral systems). Therefore, based on the current data, the stereochemical arrangement of TAG molecules in the unit cell is associated with the polymorphic form of the solid - both stereoisomers in the β form and one stereoisomer in the β' form. This perspective clearly explains the observed differences in polymorphic behavior for enantiopure and racemic TAG including the β'-stability of enantiopure systems. As a result, the current descriptive mechanism for TAG polymorphism is vastly improved when the stereochemical orientation of the constituent TAG molecules is considered.

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 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: Observational · Consensus signal: none
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.844
Threshold uncertainty score0.272

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 head0.019
GPT teacher head0.190
Teacher spread0.171 · 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 teacher head, 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

Citations10
Published2012
Admission routes1
Has abstractyes

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