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IMI European Lead Factory — democratizing access to high-throughput screening2021 Nature Reviews Drug Discovery article Computer Science Computational Drug Discovery Methods Open access
Philip S. Jones, Sylviane Boucharens, Stuart P. McElroy, Angus J. Morrison, Saman Honarnejad, Stan van Boeckel, +58 more
4citations -
FRI0585 HIGH-THROUGHPUT METHODOLOGY FOR EMR-BASED IDENTIFICATION OF CLINICAL SUB-PHENOTYPES IN COMPLEX PATIENT POPULATIONS2020 Annals of the Rheumatic Diseases conference-abstract Computer Science Machine Learning in Healthcare Open access
Marc P. Maurits, Tom W. J. Huizinga, Marcel J. T. Reinders, Soumya Raychaudhuri, Elizabeth W. Karlson, Erik B. van den Akker, +1 more
0citations -
Systematic evaluation of high-throughput PBK modelling strategies for the prediction of intravenous and oral pharmacokinetics in humans2024 Archives of Toxicology article Computer Science Computational Drug Discovery Methods Open access
René Geci, Domenico Gadaleta, Marina García de Lomana, Rita Ortega-Vallbona, Erika Colombo, Eva Serrano‐Candelas, +3 more
33citations -
Systematic Evaluation of High-Throughput PBK Modelling Strategies for the Prediction of Intravenous and Oral Pharmacokinetics in Humans2024 bioRxiv (Cold Spring Harbor Laboratory) preprint Computer Science Computational Drug Discovery Methods Open access
René Geci, Domenico Gadaleta, Marina García de Lomana, Rita Ortega-Vallbona, Erika Colombo, Eva Serrano‐Candelas, +3 more
0citations -
Automated Segmentation of Large Image Datasets using Artificial Intelligence for Microstructure Characterisation, Damage Analysis and High-Throughput Modelling Input2024 arXiv (Cornell University) preprint Computer Science Advanced Neural Network Applications Open access
Setareh Medghalchi, Joscha Kortmann, Sang-Hyeok Lee, U. Kerzel, Sandra Korte‐Kerzel
0citations -
Systematic assessment of transcriptomic and phenotypic biological profiling for mechanism-based hazard assessment using target-annotated reference chemicals in renal proximal tubular epithelial cells2026 bioRxiv (Cold Spring Harbor Laboratory) preprint Computer Science Computational Drug Discovery Methods Open access
Hugo W van Kessel, Marlene Wedler, Palle Steen Helmke, Dace Zigure, Stephen Ferguson, Joshua Harrill, +5 more
0citations -
When Next-Gen Sensing Meets Legacy Wi-Fi: Performance Analyses of IEEE 802.11bf and IEEE 802.11ax Coexistence2026 IEEE Transactions on Mobile Computing article Computer Science Wireless Networks and Protocols Open access
Navid Keshtiarast, Pradyumna Kumar Bishoyi, Ido Manuel Lumbantobing, Marina Petrova
0citations -
Bayesian calibration, process modeling and uncertainty quantification in biotechnology2021 bioRxiv (Cold Spring Harbor Laboratory) preprint Computer Science Gaussian Processes and Bayesian Inference Open access
Laura M. Helleckes, Michael Osthege, Wolfgang Wiechert, Eric von Lieres, Marco Oldiges
4citations -
Pandemic Drugs at Pandemic Speed: Infrastructure for Accelerating COVID-19 Drug Discovery with Hybrid Machine Learning- and Physics-based Simulations on High Performance Computers2021 arXiv (Cornell University) preprint Computer Science Computational Drug Discovery Methods Open access
Agastya P. Bhati, Shunzhou Wan, Austin Clyde, Mathis Bode, Mikhail Titov, André Merzky, +20 more
42citations -
Expediting hit-to-lead progression in drug discovery through reaction prediction and multi-dimensional optimization2025 Nature Communications article Computer Science Computational Drug Discovery Methods Open access
David F. Nippa, Kenneth Atz, Yannick Stenzhorn, Alex T. Müller, Andreas Tosstorff, Jörg Benz, +17 more
9citations -
Harnessing Manycore Processors with Distributed Memory for Accelerated Training of Sparse and Recurrent Models2024 Proceedings of the AAAI Conference on Artificial Intelligence conference-paper Computer Science Parallel Computing and Optimization Techniques Open access
Jan Finkbeiner, Thomas Gmeinder, Mark Pupilli, Alexander Titterton, Emre Neftci
4citations