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Environmental Science & Technology|November 1, 2023
Potential for Machine Learning to Address Data Gaps in Human Toxicity and Ecotoxicity CharacterizationKerstin von Borries, Hanna Holmquist, Marissa Kosnik, et al.
Journal of the American Chemical Society|December 24, 2014
The most reactive amide as a transition-state mimic for cis-trans interconversionIgor V Komarov, Stanislav Yanik, Aleksandr Yu Ishchenko, et al.
Chemical Research in Toxicology|December 9, 2020
Confidence in Inactive and Active Predictions from Structural AlertsAndrew J Wedlake, Timothy E H Allen, Jonathan M Goodman, et al.
Journal of the American Chemical Society|November 30, 2020
A Computational and Experimental Investigation of the Origin of Selectivity in the Chiral Phosphoric Acid Catalyzed Enantioselective Minisci ReactionKristaps Ermanis, Avene C Colgan, Rupert S J Proctor, et al.
Chemical Science|February 6, 2026
Oligomerisation and stereoselective polymerisation of alkenes and alkynes using pyridyl-based Al(iii) catalystsDipanjana Choudhury, Richard Danylyuk, Alexandros Terzopoulos, et al.
Chemical Communications (Cambridge, England)|October 30, 2009
The regioselective photochemical rearrangement of alpha-[PN(t)Bu](4)Henrike Bladt, Silvia Gonzalez Calera, Jonathan M Goodman, et al.
Environmental Science & Technology|May 21, 2020
In Silico Guidance for In Vitro Androgen and Glucocorticoid Receptor ToxCast AssaysTimothy E H Allen, Mark D Nelms, Stephen W Edwards, et al.
Chemical Science|June 14, 2021
Neural network activation similarity: a new measure to assist decision making in chemical toxicologyTimothy E H Allen, Andrew J Wedlake, Elena Gelžinytė, et al.
The Journal of Organic Chemistry|December 17, 2014
Base-mediated cascade rearrangements of aryl-substituted diallyl ethersJolene P Reid, Catherine A McAdam, Adam J S Johnston, et al.
Chemical Science|October 20, 2025
Towards automatically verifying chemical structures: the powerful combination of <sup>1</sup>H NMR and IR spectroscopyJ Benji Rowlands, Lina Jonsson, Jonathan M Goodman, et al.
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