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A Perspective for Structure–Property Reasoning to Explicate and Scaffold Thinking like a Chemist2023 Research in Science Education article Social Sciences Science Education and Pedagogy Open access
Marie-Jetta den Otter, Alma J. Kuijpers, Michiel Dam, Ludo B. F. Juurlink, Fred J. J. M. Janssen
4citations -
Transcriptome-Wide Prediction and Measurement of Combined Effects Induced by Chemical Mixture Exposure in Zebrafish Embryos2021 Environmental Health Perspectives article Environmental Science Environmental Toxicology and Ecotoxicology Open access
Andreas Schüttler, Gianina Jakobs, J.M. Fix, Martin Krayer Von Krauss, Janet Krüger, David Leuthold, +2 more
8citations -
A Chemical Biological Approach to Study G Protein-Coupled Receptors: Labeling the Adenosine A1 Receptor Using an Electrophilic Covalent Probe2022 ACS Chemical Biology article Biochemistry, Genetics and Molecular Biology Receptor Mechanisms and Signaling Open access
Bert L. H. Beerkens, Çağla Koç, Rongfang Liu, Bogdan I. Florea, Sylvia E. Le Dévédec, Laura H. Heitman, +2 more
14citations -
Benchmarking quantum chemical methods for accurate gas-phase structure predictions of carbonyl compounds: the case of ethyl butyrate2023 Physical Chemistry Chemical Physics article Physics and Astronomy Advanced Chemical Physics Studies Open access
Lilian W. Sutikdja, Ha Vinh Lam Nguyen, Dragan Jelisavac, Wolfgang Stahl, Halima Mouhib
8citations -
The development of novel glucocorticoid receptor antagonists: From rational chemical design to therapeutic efficacy in metabolic disease models2021 Pharmacological Research article Biochemistry, Genetics and Molecular Biology Estrogen and related hormone effects Open access cited by 6 patents
Jan Kroon, Eva M. G. Viho, Max Gentenaar, Lisa L. Koorneef, Cees van Kooten, Patrick C.N. Rensen, +3 more
16citations -
Using environmental monitoring data from apex predators for chemicals management: towards better use of monitoring data from apex predators in support of prioritisation and risk assessment of chemicals in Europe2022 Environmental Sciences Europe article Environmental Science Environmental Toxicology and Ecotoxicology Open access
Gabriele Treu, Jaroslav Slobodnı́k, Nikiforos A. Alygizakis, Alexander Badry, Dirk Bunke, Alessandra Cincinelli, +17 more
22citations -
Passive sampling in support of biota monitoring of hydrophobic substances under the Water Framework Directive2024 Journal of Hazardous Materials article Environmental Science Environmental Toxicology and Ecotoxicology Open access
Ian John Allan, Cécile Miège, Annika Jahnke, Elisa Rojo‐Nieto, Katrin Vorkamp, Cécile Kech, +10 more
10citations -
Atom-anchored LLMs speak Chemistry: A Retrosynthesis Demonstration2025 arXiv (Cornell University) preprint Computer Science Computational Drug Discovery Methods Open access
Alan Kai Hassen, Andrius Bernatavicius, Antonius P. A. Janssen, Mike Preuß, Gerard J. P. van Westen, Djork-Arné Clevert
0citations -
Physics-informed neural networks for dynamic process operations with limited physical knowledge and data2024 Computers & Chemical Engineering article Physics and Astronomy Model Reduction and Neural Networks Open access
Mehmet Velioglu, Song Zhai, Sophia Rupprecht, Alexander Mitsos, Andreas Jupke, Manuel Dahmen
54citations -
Application of the Closure Principle Computational Approach Test to Assess Ecotoxicological Field Studies: Comparative Analysis Using Earthworm Field Test Abundance Data2021 Environmental Toxicology and Chemistry article Environmental Science Environmental Toxicology and Ecotoxicology Open access
Benjamin Daniels, Martina Roß‐Nickoll, Stephan Jänsch, Silvia Pieper, Jörg Römbke, Björn Scholz‐Starke, +1 more
5citations -
A comprehensive experimental and modeling study of the ignition delay time characteristics of ternary and quaternary blends of methane, ethane, ethylene, and propane over a wide range of temperature, pressure, equivalence ratio, and dilution2021 Combustion and Flame article Chemical Engineering Advanced Combustion Engine Technologies Open access
Mohammadreza Baigmohammadi, Vaibhav Patel, Snehasish Panigrahy, Amrit Bikram Sahu, Shashank S. Nagaraja, Ajoy Ramalingam, +2 more
70citations