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Predictions of the Poses and Affinity of a Ligand over the Entire Surface of a NEET Protein: The Case of Human MitoNEET2023 Journal of Chemical Information and Modeling article Computer Science Computational Drug Discovery Methods Open access
Ke Zuo, Riccardo Capelli, Giulia Rossetti, Rachel Nechushtai, Paolo Carloni
8citations -
Explainable artificial intelligence (XAI) in radiology and nuclear medicine: a literature review2023 Frontiers in Medicine article Computer Science Explainable Artificial Intelligence (XAI) Open access
Bart Marius de Vries, Gerben J.C. Zwezerijnen, George Louis Burchell, Floris H. P. van Velden, C. Willemien Menke‐van der Houven van Oordt, Ronald Boellaard
104citations -
A Blueprint for High Affinity SARS-CoV-2 Mpro Inhibitors from Activity-Based Compound Library Screening Guided by Analysis of Protein Dynamics2021 ACS Pharmacology & Translational Science article Computer Science Computational Drug Discovery Methods Open access
Jonas Goßen, Simone Albani, Anton Hanke, Benjamin Philipp Joseph, Cathrine C. Bergh, Maria Kuzikov, +14 more
62citations -
Designed nanomolar small-molecule inhibitors of Ena/VASP EVH1 interaction impair invasion and extravasation of breast cancer cells2020 Proceedings of the National Academy of Sciences article Computer Science Computational Drug Discovery Methods Open access cited by 2 patents
Matthias Barone, Slim Chiha, Jiang Ren, Dominik Albat, Arne Soicke, Stephan Dohmen, +16 more
38citations -
Regeneration of pavement surface textures using M‐sigmoid‐normalized generative adversarial networks2023 Computer-Aided Civil and Infrastructure Engineering article Computer Science Generative Adversarial Networks and Image Synthesis Open access
Jiale Lu, Baofeng Pan, Weixin Ren, Quan Liu, Pengfei Liu, Markus Oeser
28citations