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Head of Group
Director of Corporate Program
His main research interests are ligand- and structure-based drug design with focus on transmembrane transport proteins, prediction of on- and off-kinetics, as well as semantic data integration.
Publications
Showing entries 146 - 150 out of 316
Seddik, A, Zdrazil, B, Weissensteiner, R, Sitte, HH & Ecker, GF 2012, 'Prioritization of docking poses in human serotonin and dopamine transporters by the use of common scaffold clustering', American Chemical Society. Abstracts of Papers (at the National Meeting), vol. 244.
Di, L, Artursson, P, Avdeef, A, Ecker, G, Faller, B, Fischer, H, Houston, JB, Kansy, M, Kerns, EH, Krämer, SD, Lennernaes, H & Sugano, K 2012, 'Evidence-based approach to assess passive diffusion and carrier-mediated drug transport', Drug Discovery Today, vol. 17, no. 15-16, pp. 905-912. https://doi.org/10.1016/j.drudis.2012.03.015
Ecker, GF & Williams-Jones, B 2012, 'Open Innovation in Drug Discovery', Molecular Informatics, vol. 31, no. 8, pp. 519-520. https://doi.org/10.1002/minf.201280004
Zdrazil, B, Blomberg, N & Ecker, G 2012, 'Taking Open Innovation to the Molecular Level - Strengths and Limitations', Molecular Informatics, vol. 31, no. 8, pp. 528-535. https://doi.org/10.1002/minf.201200014
Richter, L, de Graaf, C, Sieghart, W, Varagic, Z, Moerzinger, M, de Esch, IJP, Ecker, GF & Ernst, M 2012, 'Diazepam-bound GABA(A) receptor models identify new benzodiazepine binding-site ligands', Nature Chemical Biology, vol. 8, no. 5, pp. 455-464. https://doi.org/10.1038/NCHEMBIO.917
Activities
Showing entries 1 - 5 out of 207
AI in Drug Discovery and Toxicity Prediction
Gerhard Ecker
ARUA 2025
Conference,
Talk or oral contribution
30.10.2025 - 30.10.2025
In silico MIE Prediction
Gerhard Ecker
RISK-HUNT3R Stakeholder Symposium
Conference,
Talk or oral contribution
18.6.2025 - 18.6.2025
Prediction of Toxicity
Gerhard Ecker
CCC-Trio 2025
Conference,
Talk or oral contribution
12.6.2025 - 12.6.2025
Prediction of Toxicity - let's use Fingerprints
Gerhard Ecker
OpenTox Virtual Conference 2024
Conference,
Talk or oral contribution
29.11.2024 - 29.11.2024
In silica prediction of toxicity - from QSAR models to biological fingerprinting
Gerhard Ecker
AAPR 23 - patterns in one health
Conference,
Talk or oral contribution
25.10.2023 - 25.10.2023