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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 286 - 290 out of 312
Wailzer, B, Klocker, J, Buchbauer, G, Ecker, G & Wolschann, KP 2001, 'Prediction of the aroma quality and the threshold values of some pyrazines using artificial neural networks', Journal of Medicinal Chemistry, vol. 44, no. 17, pp. 2805-2813. https://doi.org/10.1021/jm001129m
Annibali, D, Ecker, G, Fleischhacker, W, Helml, T, Holzer, W & Noe, C 2000, 'A method for the synthesis of 2,3-disubstituted 2,3-dihydrobenzofurans', Monatshefte für Chemie, vol. 131, no. 4, pp. 375-382. https://doi.org/10.1007/s007060050318
Kaiser, D, Tmej, C, Chiba, P, Schaper, K-J & Ecker, G 2000, 'Artificial neural networks in drug design II: Influence of learning rate and momentum factor on the predictive ability', Scientia Pharmaceutica, vol. 68, no. 1, pp. 57-64.
Ecker, G, Langer, T & Wolschann, KP 2000, 'Scientia pharmaceutica: Editorial', Scientia Pharmaceutica, vol. 68, no. 1. <http://www.scopus.com/scopus/inward/record.url?eid=2-s2.0-0034732303&partner@&rel=R5.0.4>
Buchstaller, H-P, Siebert, CD, Lyssy, RH, Ecker, G, Krug, M, Berger, M, Gottschlich, R & Noe, C 2000, 'Thieno (2,3-b) pyridinones as Antagonists on the Glycine Site of the N-methyl-D-asparatate Receptor-Binding Studies, Molecular Modeling and Structure-Activity-Relationships', Scientia Pharmaceutica, no. 68, pp. 3-14.
Activities
Showing entries 1 - 5 out of 203
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
Predicting chemicals' Molecular Initiating Events (MIEs) based on protein structure
Gerhard Ecker
ASPIS Open Symposium
Conference,
Talk or oral contribution
25.11.2022 - 25.11.2022
Structure-based prediction of molecular initiating events - where are we?
Gerhard Ecker
3rd In silico Toxicology Conference 2022
Conference,
Talk or oral contribution
29.9.2022 - 29.9.2022
Transporter Informatics and Computational Toxicology - from QSAR to Machine Learning and beyond
Gerhard Ecker
Advanced summer School in Drug Research and Development
Summer/Winter school,
Talk or oral contribution
7.9.2022 - 7.9.2022