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Record W4408435835 · doi:10.5194/egusphere-egu25-7399

Modelling the fate of endocrine-disrupting chemicals during wastewater ozonation by fluorescence and artificial neural network

2025· preprint· en· W4408435835 on OpenAlexaff
Paolo Roccaro, Filippo Fazzino, Erica Gagliano, Domenico Santoro

Bibliographic record

Venuenot available
Typepreprint
Languageen
FieldEnvironmental Science
TopicWater Quality Monitoring and Analysis
Canadian institutionsWestern University
Fundersnot available
KeywordsArtificial neural networkWastewaterEnvironmental scienceBiochemical engineeringFluorescenceWaste managementEnvironmental chemistryChemistryEnvironmental engineeringComputer scienceEngineeringArtificial intelligencePhysics

Abstract

fetched live from OpenAlex

Many endocrine-disrupting chemicals (EDCs) are discharged into the aquatic environment mainly due to their incomplete removal during biological treatment at municipal wastewater treatment plants. For this reason, advanced oxidation processes (AOPs), using ozone with other oxidant agents, like hydrogen peroxide, are effective in removing EDCs. Furthermore, to reduce the risk of drinking water contamination by EDCs, it is necessary to ensure a real-time monitoring of wastewater treatment processes. Fluorescence spectroscopy could be used for wastewater quality monitoring to control the fate of EDCs in water systems. However, the complex physical, biological and chemical process involved in wastewater treatment process exhibit non-linear behaviors, which are difficult to describe by linear mathematical models. The artificial neural networks (ANNs) have been applied with remarkable success in several modeling studies including the highly non-linear ones.The main objective of the present work was to use fluorescence data and ANN to monitor two EDCs, namely a pesticide (Diuron) and a pharmaceulical and corrosion inhibitor (Benzotriazole) during advanced wastewater treatments.The data used were obtained from the pilot plant installed and operated by AquaSoil at the municipal wastewater reclamation plant of Fasano (Brindisi, Italy). The influent wastewater was obtained from tertiary treatment consisting of a coagulation stage by aluminum polychloride, sedimentation stage in lamella clarifiers and disinfection stage by sodium hypochlorite. An aliquot of the tertiary effluent was redirected to the pilot plant employing the O3/H2O2 advanced oxidation process. This process was operated in the patented technology commercialized by AquaSoil as MITO3X.Diuron and Benzotriazole were analyzed using standard methos. Fluorescence data were collected using a Shimadzu RF-5301PC fluorescence spectrophotometer at different excitation emission wavelengths, while ANN model has been developed using Matlab software with ANN toolbox to match the measured and the predicted concentrations of EDCs.The concentrations of Diuron and Benzotriazole were well correlated with selected fluorescence indexes. The combination of differente fluorescence peaks enhanced the determination coefficients of the single and multiple linear regressions. The developed ANN model that incorporated as input parameters the values of the fluorescence indices strongly enhanced the prediction of the fate of Diuron and Benzotriazole during AOPs. Therefore, the ANN-based model have been found to provide an efficient and robust tool in predicting the fate of EDCs removal. The comparison between ANN predicted data and experimental data shows the ability of artificial intelligence tools to predict EDCs concentrations with high accuracy and precision. Moreover, this model requires no additional information on the mechanism and the kinetics of chemical degradation of target contaminants. Since ANN have valuable advantages such as learning ability, dealing with imprecise, noisy and highly complex non-linear data, and parallel processing ability and due to the high sensitivity of fluorescence, it is expected that the developed fluorescence-ANN based model can be successfully applied for real-time control of AOPs employed for EDCs removal. This may also lead to AOPs optimization and cost savings.

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: Simulation or modeling · Consensus signal: Simulation or modeling
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.308
Threshold uncertainty score0.566

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 science0.0000.001
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 head0.024
GPT teacher head0.257
Teacher spread0.234 · 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 designSimulation or modeling
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".

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Citations0
Published2025
Admission routes1
Has abstractyes

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