Safe and sustainable by design: A computer-based approach to redesign chemicals for reduced environmental hazards

Outside the Safe Operating Space of the Planetary Boundary for Novel Entities

(2022) Linn Persson et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

First Steps Toward Sustainable Circular Uses of Chemicals: Advancing the Assessment and Management Paradigm

(2021) Zhanyun Wang et al.   ACS Sustainable Chemistry & Engineering

The role of planetary boundaries in assessing absolute environmental sustainability across scales

(2021) Mo Li et al.   ENVIRONMENT INTERNATIONAL

Identification of emerging safety and sustainability issues of advanced materials: Proposal for a systematic approach

(2021) Willie Peijnenburg et al.   NanoImpact

Chemical pollution: A growing peril and potential catastrophic risk to humanity

(2021) Ravi Naidu et al.   ENVIRONMENT INTERNATIONAL

Does the scientific knowledge reflect the chemical diversity of environmental pollution? – A twenty-year perspective

(2021) Erik Kristiansson et al.   ENVIRONMENTAL SCIENCE & POLICY

Rethinking chemistry for a circular economy

(2020) Klaus Kümmerer et al.   SCIENCE

Learning from the past and considering the future of chemicals in the environment

(2020) Andrew C. Johnson et al.   SCIENCE

Designing for a green chemistry future

(2020) Julie B. Zimmerman et al.   SCIENCE

Towards the sustainable synthesis of ethylene glycol

(2020) Marta C. Figueiredo   Nature Catalysis

Forward Together

(2020) Julie Beth Zimmerman   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Chemical pollution imposes limitations to the ecological status of European surface waters

(2020) Leo Posthuma et al.   Scientific Reports

A Modified 3D-QSAR Model Based on Ideal Point Method and Its Application in the Molecular Modification of Plasticizers with Flame Retardancy and Eco-Friendliness

(2020) Haigang Zhang et al.   Polymers

Persistent, mobile and toxic (PMT) and very persistent and very mobile (vPvM) substances pose an equivalent level of concern to persistent, bioaccumulative and toxic (PBT) and very persistent and very bioaccumulative (vPvB) substances under REACH

(2020) Sarah E. Hale et al.   Environmental Sciences Europe

Occurrence of emerging persistent and mobile organic contaminants in European water samples

(2019) Stefanie Schulze et al.   WATER RESEARCH

Circular chemistry to enable a circular economy

(2019) Tom Keijer et al.   Nature Chemistry

Implications of microbial adaptation for the assessment of environmental persistence of chemicals

(2019) Baptiste A. J. Poursat et al.   CRITICAL REVIEWS IN ENVIRONMENTAL SCIENCE AND TECHNOLOGY

NORMAN digital sample freezing platform: A European virtual platform to exchange liquid chromatography high resolution-mass spectrometry data and screen suspects in “digitally frozen” environmental samples

(2019) Nikiforos A. Alygizakis et al.   TRAC-TRENDS IN ANALYTICAL CHEMISTRY

Organophosphate Ester Flame Retardants: Are They a Regrettable Substitution for Polybrominated Diphenyl Ethers?

(2019) Arlene Blum et al.   Environmental Science & Technology Letters

Long-term exposure of activated sludge in chemostats leads to changes in microbial communities composition and enhanced biodegradation of 4-chloroaniline and N-methylpiperazine

(2019) Baptiste A.J. Poursat et al.   CHEMOSPHERE

Molecular Firefighting-How Modern Phosphorus Chemistry Can Help Solve the Challenge of Flame Retardancy

(2018) Maria M. Velencoso et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Metabolism of tri- n -butyl phosphate in earthworm Perionyx excavatus

(2018) Lei Wang et al.   ENVIRONMENTAL POLLUTION

The Green ChemisTREE: 20 years after taking root with the 12 principles

(2018) Hanno C. Erythropel et al.   GREEN CHEMISTRY

A path to clean water:

(2018) Klaus Kümmerer et al.   SCIENCE

Environmentally friendly polychlorinated naphthalenes (PCNs) derivatives designed using 3D-QSAR and screened using molecular docking, density functional theory and health-based risk assessment

(2018) Wenwen Gu et al.   JOURNAL OF HAZARDOUS MATERIALS

Organophosphate flame retardants (OPFRs): A review on analytical methods and occurrence in wastewater and aquatic environment

(2018) Ioanna Pantelaki et al.   SCIENCE OF THE TOTAL ENVIRONMENT

Synthetic chemicals as agents of global change

(2017) Emily S Bernhardt et al.   FRONTIERS IN ECOLOGY AND THE ENVIRONMENT

Integrated in silico strategy for PBT assessment and prioritization under REACH

(2016) Fabiola Pizzo et al.   ENVIRONMENTAL RESEARCH

Mind the Gap: Persistent and Mobile Organic Compounds—Water Contaminants That Slip Through

(2016) Thorsten Reemtsma et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Synthesis of a series of amino acid derived ionic liquids and tertiary amines: green chemistry metrics including microbial toxicity and preliminary biodegradation data analysis

(2016) Andrew Jordan et al.   GREEN CHEMISTRY

Are some “safer alternatives” hazardous as PBTs? The case study of new flame retardants

(2016) Paola Gramatica et al.   JOURNAL OF HAZARDOUS MATERIALS

Lessons learned from more than two decades of research on emerging contaminants in the environment

(2016) Katia Noguera-Oviedo et al.   JOURNAL OF HAZARDOUS MATERIALS

One-world chemistry and systems thinking

(2016) Stephen A. Matlin et al.   Nature Chemistry

Understanding the distribution, degradation and fate of organophosphate esters in an advanced municipal sewage treatment plant based on mass flow and mass balance analysis

(2016) Kang Liang et al.   SCIENCE OF THE TOTAL ENVIRONMENT

Toward the Efficient Synthesis of New Phosphopantothenate Derivatives by Using Chlorophosphate Reagents

(2016) Stojan Stavber et al.   SYNTHESIS-STUTTGART

Planetary Boundaries: Exploring the Safe Operating Space for Humanity

(2016) Johan Rockström et al.   ECOLOGY AND SOCIETY

Advancing Safer Alternatives Through Functional Substitution

(2015) Joel A. Tickner et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Re-Designing of Existing Pharmaceuticals for Environmental Biodegradability: A Tiered Approach with β-Blocker Propranolol as an Example

(2015) Tushar Rastogi et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

The washout effect during laundry on benzothiazole, benzotriazole, quinoline, and their derivatives in clothing textiles

(2015) Giovanna Luongo et al.   ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH

Prediction of the Fate of Organic Compounds in the Environment From Their Molecular Properties: A Review

(2014) Laure Mamy et al.   CRITICAL REVIEWS IN ENVIRONMENTAL SCIENCE AND TECHNOLOGY

Synthesis of an Oxidation-Stable Analogue of Cyclic Pyranopterin Monophosphate (cPMP)

(2014) Stefan Hilken et al.   EUROPEAN JOURNAL OF ORGANIC CHEMISTRY

In silico models for predicting ready biodegradability under REACH: A comparative study

(2013) Fabiola Pizzo et al.   SCIENCE OF THE TOTAL ENVIRONMENT

Modeling and predicting aquatic aerobic biodegradation – a review from a user's perspective

(2012) Christoph Rücker et al.   GREEN CHEMISTRY

QSAR Modeling is not “Push a Button and Find a Correlation”: A Case Study of Toxicity of (Benzo-)triazoles on Algae

(2012) Paola Gramatica et al.   Molecular Informatics

OMG: Open Molecule Generator

(2012) Julio E Peironcely et al.   Journal of Cheminformatics

Hypothesis driven drug design: improving quality and effectiveness of the design-make-test-analyse cycle

(2011) Alleyn T. Plowright et al.   DRUG DISCOVERY TODAY

Recent Developments in Halogen Free Flame Retardants for Epoxy Resins for Electrical and Electronic Applications

(2010) Muriel Rakotomalala et al.   Materials