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Using Benchmarking To Strengthen the Assessment of Persistence

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High-performance biochar-loaded MgAl-layered double oxide adsorbents derived from sewage sludge towards nanoplastics removal: Mechanism elucidation and QSAR modeling

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In silico environmental chemical science: properties and processes from statistical and computational modelling

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Unveil the quantum chemical descriptors determining direct photodegradation of antibiotics under simulated sunlight: Batch experiments and model development

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QSPR studies on water solubility, octanol-water partition coefficient and vapour pressure of pesticides

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Computing p K a Values in Different Solvents by Electrostatic Transformation

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Selecting Adsorbents to Separate Diverse Near-Azeotropic Chemicals

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Comparison of Small Molecule Biotransformation Half-Lives between Activated Sludge and Soil: Opportunities for Read-Across?

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Environmental risk assessment of pesticides: state of the art and prospective improvement from science

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Improving predictions and understanding of primary and ultimate biodegradation rates with machine learning models

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Prediction of PFAS bioaccumulation in different plant tissues with machine learning models based on molecular fingerprints

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Pharmaceuticals in Water and Wastewater: A Review on Ecological Risk and Sustainable Treatment Options

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Development and application of relevance and reliability criteria for water treatment removal efficiencies of chemicals of emerging concern

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Essential oils from fennel plants as valuable chemical products: gas chromatography–mass spectrometry, FTIR, quantum mechanical investigation, and antifungal activity

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Long-term willows phytoremediation treatment of soil contaminated by fly ash polycyclic aromatic hydrocarbons from straw combustion

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A QSAR for the prediction of rate constants for the reaction of VOCs with nitrate radicals

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Hydrophilic interaction liquid chromatography of aminoglycoside antibiotics with a diol-type stationary phase

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Microbial growth yield estimates from thermodynamics and its importance for degradation of pesticides and formation of biogenic non-extractable residues

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Assessment of pesticides volatilization potential based on their molecular properties using the TyPol tool

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Moving persistence assessments into the 21st century: A role for weight-of-evidence and overall persistence

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Mapping atrazine persistence in soils of central Argentina using INLA

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A Bayesian framework for estimating parameters of a generic toxicokinetic model for the bioaccumulation of organic chemicals by benthic invertebrates: Proof of concept with PCB153 and two freshwater species

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Sorption and desorption behavior of residual antidepressants and caffeine in freshwater sediment and sewage sludge

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Modeling uptake of nanoparticles in multiple human cells using structure–activity relationships and intercellular uptake correlations

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How machine learning boosts the understanding of organic pollutant adsorption on carbonaceous materials: A comprehensive review with statistical insights

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A comprehensive review on the adsorptive removal of pharmaceutical pollutants: Occurrence, toxicology, molecular simulation and mechanistic insights

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Quantitative Structure-Activity Relationship Model for HCVNS5B inhibitors based on an Antlion Optimizer-Adaptive Neuro-Fuzzy Inference System

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Suspect screening of environmental contaminants by UHPLC-HRMS and transposable Quantitative Structure-Retention Relationship modelling

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Quantitative structure–activity relationship(QSAR) models for color and COD removal for some dyes subjected to electrochemical oxidation

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Boosting visible-light photodegradation of methyl orange and ibuprofen over rGO-supported Ag3PO4 nanocomposite

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Design, synthesis and evaluation of 3-arylidene azetidin-2-ones as potential antifungal agents against Alternaria solani Sorauer

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Quantitative structure–property relationship of the photoelectrochemical oxidation of phenolic pollutants at modified nanoporous titanium oxide using supervised machine learning

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Effect of layered double hydroxides on the VOCs emission and the properties of SBS modified asphalt

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Clustering pesticides according to their molecular properties, fate, and effects by considering additional ecotoxicological parameters in the TyPol method

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Effects of Cu and Ni co-doping on magnetic, photocatalytic and dielectric properties of Co3O4 nanoparticles

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Prediction and Structure–Activity Relationship Analysis on Ready Biodegradability of Chemical Using Machine Learning Method

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Congener-specific uptake and accumulation of bisphenols in edible plants: Binding to prediction of bioaccumulation by attention mechanism multi-layer perceptron machine learning model

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Versatile applications of cobalt and copper complexes of biopolymeric Schiff base ligands derived from chitosan

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Understanding requirements, limitations and applicability of QSAR and PTF models for predicting sorption of pollutants on soils: a systematic review

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p K a prediction in non‐aqueous solvents

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Persistent organic pollutants (POPs) - QSPR classification models by means of Machine learning strategies

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Application of quantitative structure-property relationship analysis to estimate the vapor pressure of pesticides

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Quality screening of the Lagos lagoon sediment by assessing the cytotoxicity and toxicological responses of rat hepatoma H4IIE and fish PLHC-1 cell-lines using different extraction approaches

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Machine learning models based on molecular descriptors to predict human and environmental toxicological factors in continental freshwater

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Categorizing chlordecone potential degradation products to explore their environmental fate

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Widespread Misinterpretation of p K a Terminology for Zwitterionic Compounds and Its Consequences

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Synthesis, anti-parasitic activity and QSAR study of a new library of polysubstituted tetrahydronaphtho[1,2-b]azepines

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From Volatile Profiling to Sensory Prediction: Recent Advances in Wine Aroma Modeling Using Chemometrics and Sensor Technologies

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Intertwined role of mechanism identification by DFT-XAFS and engineering considerations in the evolution of P adsorbents

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Degradation of aliphatic halogenated contaminants in water by UVA/Cu–TiO2 and UVA/TiO2 photocatalytic processes: Structure-activity relationship and role of reactive species

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Kinetic analysis and degradation mechanism for natural attenuation of xylenes under simulated marine conditions

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Diethylenetriamine as a selective pyrrhotite depressant: Properties, application, and mitigation strategies

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Prediction and mechanism analysis of octanol-air partition coefficient for persistent organic pollutants based on machine learning models

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A novel ZnMn2O4/g-C3N4 nanocomposites heterojunction photocatalyst: preparation, characterization, and investigation of photocatalytic behavior over toxic dyes

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Interrogating Plant-Microbe Interactions with Chemical Tools: Click Chemistry Reagents for Metabolic Labeling and Activity-Based Probes

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Linking Clusters of Micropollutants in Surface Water to Emission Sources, Environmental Conditions, and Substance Properties

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The leaching behaviour of herbicides in cropping soils amended with forestry biowastes

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Advancing Maternal Transfer of Organic Pollutants across Reptiles for Conservation and Risk Assessment Purposes

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Assessing the effects of Awba dam sediment (Nigeria) on the steroidogenesis of H295R cells using different extraction methods

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Block‐wise Exploration of Molecular Descriptors with Multi‐block Orthogonal Component Analysis (MOCA)

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Evaluation of biological properties and fate in the environment of a new class of biosurfactants

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A regression-based model to predict chemical migration from packaging to food

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Alkali-treatment of Lupine peels for valorizing adsorption of organic cationic pollutants from wastewater: Kinetics, isotherm, thermodynamic, regeneration, and mechanism

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Applications of machine learning-based quantitative structure activity relationship (ML-QSAR) models in environmental science

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Atom-Type-Based AI Topological Indices for Artificial Neural Network Modeling of Retention Indices of Monomethylalkanes

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Meta-analysis on penconazole sorption to soils – Modeling variability of KOC and nonlinear isotherm parameters

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