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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
10citations -
bioacoustic-ai/bacpipe: bacpipe v1.3.5 Release Notes2026 Zenodo (CERN European Organization for Nuclear Research) software Computer Science Music and Audio Processing Open access
Vincent S. Kather, Sylvain Haupert, Clea Parcerisas, Santiago Martínez Balvanera, Ines Nolasco, Ben McEwen, +2 more
0citations -
Decoder Dependence in Surface-Code Threshold Estimation with Native Gottesman-Kitaev-Preskill Digitization and Parallelized Sampling2026 arXiv (Cornell University) preprint Computer Science Quantum Computing Algorithms and Architecture Open access
Dennis Delali Kwesi Wayo, Chinonso Onah, Leonardo Goliatt, Sven Groppe
0citations -
Decoder Dependence in Surface-Code Threshold Estimation with Native Gottesman-Kitaev-Preskill Digitization and Parallelized Sampling2026 arXiv (Cornell University) preprint Computer Science Quantum Computing Algorithms and Architecture Open access
Dennis Delali Kwesi Wayo, Chinonso Onah, Leonardo Goliatt, Sven Groppe
0citations -
Identification of mitochondrial toxicants by combined in silico and in vitro studies – A structure-based view on the adverse outcome pathway2020 Computational Toxicology article Computer Science Computational Drug Discovery Methods Open access
Florentina Troger, Johannes Delp, Melina Funke, Wanda van der Stel, Claire Colas, Marcel Leist, +2 more
22citations -
Navigating the complexities of docking tools with nicotinic receptors and acetylcholine binding proteins in the realm of neonicotinoids2024 Ecotoxicology and Environmental Safety article Computer Science Computational Drug Discovery Methods Open access
Zakaria Bouchouireb, Damien Olivier‐Jimenez, Titouan Jaunet‐Lahary, Steeve Hervé Thany, Jean‐Yves Le Questel
14citations -
Missing the mark? Identifying child sexual abuse material forum structure and key-players based on public replies and private messaging networks2024 Humanities and Social Sciences Communications article Computer Science Cybercrime and Law Enforcement Studies Open access
Frederic M. Gnielka, Rebecca Reichel, ARJAN A. J. BLOKLAND, Anton Daser, Meike de Boer, Colm Gannon, +5 more
6citations