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Record W1969445291 · doi:10.1021/ma0110406

Electrophoretic Separation of Long Polyelectrolytes in Submolecular-Size Constrictions:  A Monte Carlo Study

2002· article· en· W1969445291 on OpenAlexaff
Frédéric Tessier, Josée Labrie, Gary W. Slater

Bibliographic record

VenueMacromolecules · 2002
Typearticle
Languageen
FieldEngineering
TopicNanopore and Nanochannel Transport Studies
Canadian institutionsUniversity of Ottawa
Fundersnot available
KeywordsMonte Carlo methodNucleationPolyelectrolyteChemistryChemical physicsMolecular dynamicsStatistical physicsPhysicsComputational chemistryPolymer

Abstract

fetched live from OpenAlex

We use a bond-fluctuation Monte Carlo method to study the motion of long polyelectrolytes inside an array of microscopic entropic traps. The molecules are pulled through the array by an electric field and forced into submolecular-size constrictions between the larger trap regions. We numerically solve the Laplace equation inside the structure to obtain realistic field lines for our simulations. We find that the mobility of the molecules increases with molecular size and that the size-separation mechanism relies mainly on the overall deformation of the molecules as they approach the narrow constrictions. We also investigate specific aspects of the separation mechanism, namely the conformational behavior of the molecule, the hernia nucleation process, and the trapping time statistics as a function of molecular size and field strength. Our simulation results for the mobility, the critical hernia nucleation size, the mean trapping time, and the resolution are consistent with the experimental data and model previously published by Han et al. 1,2 Finally, we predict that such microfluidic structures could be used to separate topoisomers bearing the same molecular size.

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: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.204
Threshold uncertainty score0.902

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.001
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 head0.007
GPT teacher head0.209
Teacher spread0.201 · 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 designBench or experimental
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

Citations86
Published2002
Admission routes1
Has abstractyes

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