Ulf Norinder

Uppsala University — Sweden

Computer Science · Physical Sciences

47h-index8.4kcitations245works7.32yr avg
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Research Topics

Computational Drug Discovery Methods(121), Analytical Chemistry and Chromatography(35), Machine Learning in Materials Science(26), Synthesis and Properties of Aromatic Compounds(19), Drug Transport and Resistance Mechanisms(16)

Publications245 total

Classification of industrial chemicals for respiratory chemosensory irritation using the TRPV1-expressing neuronal SH-SY5Y cell model and machine learning
Archives of Toxicology·2026Open Access
Molecular networking, conformal predictions and revised fingerprint-based models for discovering endocrine disruptors in mixtures
Analytical and Bioanalytical Chemistry·2026Open Access
Safe-and-sustainable-by-design approach to polyesters from non-oestrogenic bisphenols
Nature Sustainability·2025· 3 citedOpen Access
Rapid traversal of vast chemical space using machine learning-guided docking screens
Nature Computational Science·2025· 39 citedOpen Access
Prediction of the classification, labelling and packaging regulation H-statements with confidence using conformal prediction with N-grams and molecular fingerprints
Current Research in Toxicology·2025· 1 citedOpen Access
Safe-and-Sustainable-by-Design Approach to Non-Toxic Bisphenol Polymers
2024Open Access
CPSign: conformal prediction for cheminformatics modeling
Journal of Cheminformatics·2024· 13 citedOpen Access
A methodology to correctly assess the applicability domain of cell membrane permeability predictors for cyclic peptides
Digital Discovery·2024· 4 citedOpen Access
Toward safer and more sustainable by design biocatalytic amide-bond coupling
Green Chemistry·2024· 6 citedOpen Access
CPSign - Conformal Prediction for Cheminformatics Modeling
2023· 1 citedOpen Access
A safer and more sustainable by design perspective in biocatalytic amide-bond coupling of in silico controlled chemical space
2023· 1 citedOpen Access
Predicting Larch Casebearer damage with confidence using Yolo network models and conformal prediction
Remote Sensing Letters·2023· 3 citedOpen Access
Collaborative SAR Modeling and Prospective In Vitro Validation of Oxidative Stress Activation in Human HepG2 Cells
Journal of Chemical Information and Modeling·2023· 3 citedOpen Access
Rapid Traversal of Ultralarge Chemical Space using Machine Learning Guided Docking Screens
2023· 8 citedOpen Access
Large-scale Docking Datasets for Machine Learning
2023· 1 citedOpen Access
Large-scale Docking Datasets for Machine Learning
Zenodo (CERN European Organization for Nuclear Research)·2023Open Access
Large-scale Docking Datasets for Machine Learning
Zenodo (CERN European Organization for Nuclear Research)·2023Open Access
<i>In Silico</i> Prediction of Eye Irritation Using Hansen Solubility Parameters and Predicted pKa Values
Alternatives to Laboratory Animals·2023· 4 citedOpen Access
hERG-toxicity prediction using traditional machine learning and advanced deep learning techniques
Current Research in Toxicology·2023· 18 citedOpen Access
Traditional Machine and Deep Learning for Predicting Toxicity Endpoints
Molecules·2022· 10 citedOpen Access
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Frequent Co-authors

Per Artursson(13), Christel A. S. Bergström(9), Lars Carlsson(7), Thomas Österberg(7), Pär Matsson(6), Scott Boyer(6), Fredrik Svensson(5), Kristina Luthman(4), Martin Eklund(4), Jenny M. Pedersen(3), Ola Spjuth(3), Andreas Bender(3), Emilio Benfenati(2), Nina Jeliazkova(2), Gustav Ahlin(2), Henrik Boström(2), Åke Bergman(2), Ian A. Cotgreave(2), Jonathan Alvarsson(2), O. WENNERSTROEM(2)