| Immobilized artificial membrane-chromatographic and computational descriptors in studies of soil-water partition of environmentally relevant compounds | | |
| Prioritizing Pharmaceutical Contaminants in Great Lakes Tributaries Using Risk‐Based Screening Techniques | | 2022 |
| Prediction of acute toxicity to Daphnia magna and interspecific correlation: a global QSAR model and a Daphnia-minnow QTTR model | SAR and QSAR in Environmental Research | |
| Polycyclic aromatic hydrocarbons (PAHs) and their alkylated, nitrated and oxygenated derivatives in the atmosphere over the Mediterranean and Middle East seas | Atmospheric Chemistry and Physics | 2022 |
| The comparative performance of lightweight green wall media for the removal of xenobiotic organic compounds from domestic greywater | Water Research | 2022 |
| Prenatal Exposure to Emerging Plasticizers and Synthetic Antioxidants and Their Potency to Cross Human Placenta | Environmental Science & Technology | 2022 |
| The role of ‘big data’ and ‘in silico’ New Approach Methodologies (NAMs) in ending animal use – a commentary on progress | Computational Toxicology | 2022 |
| Toxicity impacts in the environmental footprint method: calculation principles | International Journal of Life Cycle Assessment | 2022 |
| Toxicity tests, bioaccumulation and residuality of pyrethroid insecticides commonly used to control conifer bark beetles in Mexico. | Ecotoxicology | 2022 |
| Association phosphite x fungicide: protection against powdery mildew in soybean plants, translocation and computer simulation | Journal of Plant Pathology | |
| A Framework for Incorporating Transient Solute-Keratin Binding Into Dermal Absorption Models. | Journal of Pharmaceutical Sciences | 2022 |
| Effect of Enterohepatic Circulation on the Accumulation of Per- and Polyfluoroalkyl Substances: Evidence from Experimental and Computational Studies. | Environmental Science & Technology | 2022 |
| Systematic identification of trimethoprim metabolites in lettuce. | Analytical and Bioanalytical Chemistry | 2022 |
| Risk Assessment of 1,2,4-Triazole-Typed Fungicides for Groundwater Pollution Using Leaching Potential Indices | Water, Air, and Soil Pollution | 2021 |
| Read-Across for Regulatory Ecotoxicology | Methods in Pharmacology and Toxicology | 2020 |
| QSARs and Read-Across for Thiochemicals: A Case Study of Using Alternative Information for REACH Registrations | Methods in Pharmacology and Toxicology | 2020 |
| Physicochemical Properties of POPs and their Environmental Partitioning Characteristics | Material Cycles and Waste Management Research | 2018 |
| Evaluation of Adsorption Characteristics of a Fibrous Adsorbent Containing Zwitter-Ionic Functional Group, Targeting Organic Acids | Journal of UOEH | 2017 |
| A Database of Experimentally Derived and Estimated Octanol–Air Partition Ratios (KOA) | Journal of Physical and Chemical Reference Data | 2021 |
| Improving the Estimation Accuracy of the AIST-SHANEL Model by Traction Coefficient Calibration of Multiple Surfactants | Journal of Japan Society on Water Environment | 2018 |
| Comparison of chemical-use between hydraulic fracturing, acidizing, and routine oil and gas development | PLoS ONE | 2017 |
| Relevance of Transcriptomics for Mode of Action Assessment | Chemical Research in Toxicology | 2021 |
| Predicted Environmental Concentrations: A Useful Tool to Evaluate the Presence of Cytostatics in Surface Waters | | 2020 |
| VEGAHUB for Ecotoxicological QSAR Modeling | Methods in Pharmacology and Toxicology | 2020 |
| Combination of Read-Across and QSAR for Ecotoxicity Prediction: A Case Study of Green Algae Growth Inhibition Toxicity Data | Methods in Pharmacology and Toxicology | 2020 |
| An Exercise Demonstrating the Selection of Greener Compounds for a Specified Application | Journal of Chemical Education | 2021 |
| Environmental risk assessments of multiclass pharmaceutical active compounds: selection of high priority concern pharmaceuticals using entropy-utility functions | Environmental Science and Pollution Research | 2021 |
| Fate processes of Parabens, Triclocarban and Triclosan during wastewater treatment: assessment via field measurements and model simulations | Environmental Science and Pollution Research | 2021 |
| Strategies to Tackle the Waste Water from α-Tocopherol-Derived Surfactant Chemistry | Organic Process Research and Development | 2021 |
| Tube-in-tube membrane photoreactor as a new technology to boost sulfate radical advanced oxidation processes | Water Research | 2021 |
| Shaping Effective Practices for Incorporating Sustainability Assessment in Manuscripts Submitted to ACS Sustainable Chemistry & Engineering: An Initiative by the Editors | ACS Sustainable Chemistry and Engineering | 2021 |
| Stability Assessment of a Polymeric Brominated Flame Retardant in Polystyrene Foams under Application-Relevant Conditions | Environmental Science & Technology | 2021 |
| Accurate Computational Model for the Hydration Extent of Atmospherically Relevant Carbonyls on Aqueous Atmospheric Particles | ACS Earth and Space Chemistry | 2021 |
| Degradation of pharmaceuticals in wastewater matrices through solar light-driven photocatalyst prepared from petrochemical waste | Environmental Science and Pollution Research | 2021 |
| Combined leaching and plant uptake simulations of PFOA and PFOS under field conditions | Environmental Science and Pollution Research | 2021 |
| Regulation of Persistent Chemicals in Hazardous Waste: A Case Study of Washington State, USA | Integrated Environmental Assessment and Management | 2021 |
| The nexus between alternatives assessment and green chemistry: supporting the development and adoption of safer chemicals | Green Chemistry Letters and Reviews | 2021 |
| Occurrence, fate and mass loading of benzodiazepines and their transformation products in eleven wastewater treatment plants in Guangdong province, China | Science of the Total Environment | 2021 |
| Determination of environmental properties and toxicity of octyl-dimethyl-para-aminobenzoic acid and its degradation products | Journal of Hazardous Materials | 2021 |
| A quest to identify suitable organic tracers for estimating children's dust ingestion rates | Journal of Exposure Science and Environmental Epidemiology | 2021 |
| Retrospective screening of high-resolution mass spectrometry archived digital samples can improve environmental risk assessment of emerging contaminants: A case study on antifungal azoles | Environment International | 2020 |
| Principles of QSAR Modeling | International Journal of Quantitative Structure-Property Relationships | 2020 |
| Experimental Determination of Octanol–Water Partition Coefficients of Selected Natural Toxins | Journal of Chemical & Engineering Data | 2020 |
| Comparison of Small Molecule Biotransformation Half-Lives between Activated Sludge and Soil: Opportunities for Read-Across? | Environmental Science & Technology | 2020 |
| Predicted concentrations of anticancer drugs in the aquatic environment: What should we monitor and where should we treat? | Journal of Hazardous Materials | 2020 |
| An automated framework for compiling and integrating chemical hazard data | Clean Technologies and Environmental Policy | 2020 |
| Halogenated organic contaminants of concern in urban-influenced waters of Lake Ontario, Canada: Passive sampling with targeted and non-targeted screening | Environmental Pollution | 2020 |
| Findings of the Second Challenge to Predict Aqueous Solubility | Journal of Chemical Information and Modeling | 2020 |
| Systematic assessment of working fluid mixtures for absorption refrigeration based on techno-economic, environmental, health and safety performance | Energy Conversion and Management | 2020 |
| Prediction of liquid chromatographic retention time using quantitative structure-retention relationships to assist non-targeted identification of unknown metabolites of phthalates in human urine with high-resolution mass spectrometry | Journal of Chromatography A | 2020 |
| Indoor secondary organic aerosols: Towards an improved representation of their formation and composition in models | Atmospheric Environment | 2020 |
| Addressing the use and end-of-life phase of pharmaceutical products in life cycle assessment | International Journal of Life Cycle Assessment | 2020 |
| Essential Quality Parameters of Plasticizers | | 2020 |
| The role of data source selection in chemical hazard assessment: A case study on organic photovoltaics | Journal of Hazardous Materials | 2019 |
| Ambit-GCM: An Open-source Software Tool for Group Contribution Modelling | Molecular Informatics | 2019 |
| After Salisbury Nerve Agents Revisited | Molecular Informatics | 2019 |
| How in silico and QSAR approaches can increase confidence in environmental hazard and risk assessment | Integrated Environmental Assessment and Management | 2019 |
| Applicability of Soil Concentration for VOC-Contaminated Site Assessments Explored Using Field Data from the Beijing-Tianjin-Hebei Urban Agglomeration | Environmental Science & Technology | 2019 |
| A study on computerized selection of fluorescent dyes for environmentally friendly textile applications | Dyes and Pigments | 2019 |
| How to Prepare a Compound Collection Prior to Virtual Screening | Methods in Molecular Biology | 2019 |
| Hormones and Pharmaceuticals in Groundwater Used As a Source of Drinking Water Across the United States | Environmental Science & Technology | 2019 |
| Comprehensive two-dimensional gas-chromatography-based property estimation to assess the fate and behavior of complex mixtures: A case study of vehicle engine oil | Science of the Total Environment | 2019 |
| Using the concordance of in vitro and in vivo data to evaluate extrapolation assumptions | PLoS ONE | 2019 |
| Fate of Emerging Pollutants | Assa, Cssa and Sssa | 2019 |
| Concentration dependence of in vitro biotransformation rates of hydrophobic organic sunscreen agents in rainbow trout S9 fractions: Implications for bioaccumulation assessment | Environmental Toxicology and Chemistry | 2019 |
| QSAR study of human epidermal growth factor receptor (EGFR) inhibitors: conformation-independent models | Medicinal Chemistry Research | 2019 |
| C α-Bromo-Chloro "Alkenes": Characterization of a Poorly Identified Flame Retardant and Potential Environmental Implications | Environmental Science & Technology | 2019 |
| Predictive deep learning models for environmental properties: the direct calculation of octanol–water partition coefficients from molecular graphs | Green Chemistry | 2019 |
| QSAR studies of the antioxidant activity of anthocyanins | Journal of Food Science and Technology | 2019 |
| Identification of Sulfonated and Hydroxy-Sulfonated Polychlorinated Biphenyl (PCB) Metabolites in Soil: New Classes of Intermediate Products of PCB Degradation? | Environmental Science & Technology | 2019 |
| Aqueous chlorination of benzodiazepines diazepam and oxazepam: Kinetics, transformation products and reaction pathways | Chemical Engineering Journal | 2018 |
| The influence of solid-liquid coefficient in the fate of pharmaceuticals and personal care products in aerobic wastewater treatment | Environmental Science and Pollution Research | 2018 |
| Criegee Intermediate Reactions with Carboxylic Acids: A Potential Source of Secondary Organic Aerosol in the Atmosphere | ACS Earth and Space Chemistry | 2018 |
| Comprehensive organic emission profiles for gasoline, diesel, and gas-turbine engines including intermediate and semi-volatile organic compound emissions | Atmospheric Chemistry and Physics | 2018 |
| Pharmaceuticals released from senior residences: occurrence and risk evaluation | Environmental Science and Pollution Research | 2018 |
| Estimation of physical properties of amino acids by group-contribution method | Chemical Engineering Science | 2018 |
| A Review of the Chemistry, Pesticide Use, and Environmental Fate of Sulfur Dioxide, as Used in California | Reviews of Environmental Contamination and Toxicology | 2019 |
| Bioconcentration model for non-ionic, polar, and ionizable organic compounds in amphipod | Environmental Toxicology and Chemistry | 2018 |
| Green Chemistry Metrics | | 2018 |
| Application of prioritization approaches to optimize environmental monitoring and testing of pharmaceuticals | Journal of Toxicology and Environmental Health - Part B: Critical Reviews | 2018 |
| The potential to use QSAR to populate ecotoxicity characterisation factors for simplified LCIA and chemical prioritisation | International Journal of Life Cycle Assessment | 2018 |
| Quantifying variability in removal efficiencies of chemicals in activated sludge wastewater treatment plants - a meta-analytical approach | Environmental Sciences: Processes and Impacts | 2018 |
| In Silico Screening-Level Prioritization of 8468 Chemicals Produced in OECD Countries to Identify Potential Planetary Boundary Threats | Bulletin of Environmental Contamination and Toxicology | 2018 |
| Estimating system parameters for solvent-water and plant cuticle-water using quantum chemically estimated Abraham solute parameters | Environmental Sciences: Processes and Impacts | 2018 |
| The Green ChemisTREE: 20 years after taking root with the 12 principles | Green Chemistry | 2018 |
| Quaternary (triphenyl-) phosphonium compounds: Environmental behavior and toxicity | Water Research | 2018 |
| Limononic Acid Oxidation by Hydroxyl Radicals and Ozone in the Aqueous Phase | Environmental Science & Technology | 2018 |
| The CompTox Chemistry Dashboard: a community data resource for environmental chemistry | Journal of Cheminformatics | 2017 |
| Rapid Collection of Basic Drugs in Water by a Coagulation-flotation Method | Bunseki Kagaku | 2017 |
| Critical assessment of pendimethalin in terms of persistence, bioaccumulation, toxicity, and potential for long-range transport | Journal of Toxicology and Environmental Health - Part B: Critical Reviews | 2017 |
| Dermal absorption of benzo[a]pyrene into human skin from soil: Effect of artificial weathering, concentration, and exposure duration | Journal of Exposure Science and Environmental Epidemiology | 2017 |
| Removal of organic contaminants in bioretention medium amended with activated carbon from sewage sludge | Environmental Science and Pollution Research | 2017 |
| The conformation-independent QSPR approach for predicting the oxidation rate constant of water micropollutants | Environmental Science and Pollution Research | 2017 |
| Models for integrating toxicology concepts into chemistry courses and programs | Green Chemistry Letters and Reviews | 2017 |
| Improving substance information in USEtox , part 2: Data for estimating fate and ecosystem exposure factors | Environmental Toxicology and Chemistry | 2017 |
| Phase Ratio and Equilibrium Constant in RP-HPLC Obtained from Octanol/Water Partition Constant Through Solvophobic Theory | Chromatographia | 2017 |
| Ab initio chemical safety assessment: A workflow based on exposure considerations and non-animal methods | Computational Toxicology | 2017 |
| Predicting the bioconcentration factor through a conformation-independent QSPR study | SAR and QSAR in Environmental Research | 2017 |
| High-throughput screening of chemicals as functional substitutes using structure-based classification models | Green Chemistry | 2017 |
| Measurement and correlation of flavanone, tangeritin, nobiletin, 6-hydroxyflavanone and 7-hydroxyflavone solubilities in supercritical CO 2 | Journal of Supercritical Fluids | 2017 |
| Read-across of ready biodegradability based on the substrate specificity of N-alkyl polypropylene polyamine-degrading microorganisms | SAR and QSAR in Environmental Research | 2017 |
| A framework for an alternatives assessment dashboard for evaluating chemical alternatives applied to flame retardants for electronic applications | Clean Technologies and Environmental Policy | 2017 |
| Fragment-based approach to calculate hydrophobicity of anionic and nonionic surfactants derived from chromatographic retention on a C stationary phase | Environmental Toxicology and Chemistry | 2017 |
| Disposition of the emerging brominated flame retardant, bis(2-ethylhexyl) tetrabromophthalate, in female Sprague Dawley rats: effects of dose, route and repeated administration | Xenobiotica | 2017 |
| Fluorescent Lipid Nanoparticles as Biomembrane Models for Exploring Emerging Contaminant Bioavailability Supported by Density Functional Theory Calculations | Environmental Science & Technology | 2016 |
| Disposition of the Emerging Brominated Flame Retardant, 2-Ethylhexyl 2,3,4,5-Tetrabromobenzoate, in Female SD Rats and Male B6C3F1 Mice: Effects of Dose, Route, and Repeated Administration | Toxicological Sciences | 2016 |
| Investigation of the Soil Sorption of Neutral and Basic Pesticides | Water, Air, and Soil Pollution | 2016 |
| Kinetics of Rapid Covalent Bond Formation of Aniline with Humic Acid: ESR Investigations with Nitroxide Spin Labels | Applied Magnetic Resonance | 2016 |
| Predicting algal growth inhibition toxicity: three-step strategy using structural and physicochemical properties | SAR and QSAR in Environmental Research | 2016 |
