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Record W2017026184 · doi:10.1002/cjce.20254

A Bayesian experimental design approach for assessing new product performance: An application to disinfectant formulation

2010· article· en· W2017026184 on OpenAlexaffvenueabout
Navid Omidbakhsh, Thomas A. Duever, Ali Elkamel, Park M. Reilly

Bibliographic record

VenueThe Canadian Journal of Chemical Engineering · 2010
Typearticle
Languageen
FieldChemical Engineering
TopicChemical and Physical Properties in Aqueous Solutions
Canadian institutionsUniversity of Waterloo
Fundersnot available
KeywordsHydrogen peroxideBiochemical engineeringDisinfectantComputer scienceBayesian experimental designBayesian probabilityProcess engineeringStability (learning theory)AntimicrobialBayesian inferenceChemistryEngineeringBayesian statisticsMachine learningArtificial intelligenceOrganic chemistry

Abstract

fetched live from OpenAlex

Abstract This paper presents a Bayesian methodology for computer‐aided experimental design for hydrogen peroxide formulations. Hydrogen peroxide is one of the oldest known active antimicrobial chemicals and is used in many cleaning/disinfecting formulations. It is favourable as an active antimicrobial in that it degrades only to water and oxygen, and does not contaminate the environment. However hydrogen peroxide is difficult to stabilise, and disinfecting products based on it soon lose their antimicrobial activity. Moreover, regulatory agencies such as U.S. Environmental Protection Agency (EPA) and Health Canada require that disinfecting products do not lose more than 5–10% of their active concentration throughout their shelf life. Therefore, it is very important while formulating hydrogen peroxide‐based products to test for their stability. An effective way to improve hydrogen peroxide stability in a solution is to use stabilisers. It is desired to use these chemicals in as low concentrations as possible for environmental and economic considerations. On the other hand, due to tight market competition, the new products need to be formulated as quickly as possible, and therefore there is limited time to ensure product stability. In this paper, prior information has been used in the form of a model, based on historical experiments. A Bayesian D‐optimality criterion is used to design a few additional experiments so that the resulting model can have an acceptable prediction power. It is shown that a design which uses the Bayesian D‐optimality criterion taking advantage of prior information can be more efficient than even a resolution IV fractional factorial design in the sense that using fewer trials gives a model with equivalent prediction capability. This can be critical where experiments are expensive to perform.

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: none
Teacher disagreement score0.548
Threshold uncertainty score0.548

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 integrity0.0000.001
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 head0.018
GPT teacher head0.237
Teacher spread0.219 · 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

Citations3
Published2010
Admission routes3
Has abstractyes

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