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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 26 - 30 out of 312
Loser, D, Hinojosa, MG, Blum, J, Schaefer, J, Brüll, M, Johansson, Y, Suciu, I, Grillberger, K, Danker, T, Möller, C, Gardner, I, Ecker, GF, Bennekou, SH, Forsby, A, Kraushaar, U & Leist, M 2021, 'Functional alterations by a subgroup of neonicotinoid pesticides in human dopaminergic neurons', Archives of Toxicology, vol. 95, no. 6, pp. 2081-2107. https://doi.org/10.1007/s00204-021-03031-1
Niello, M, Cintulová, D, Raithmayr, P, Holy, M, Jäntsch, K, Colas, C, Ecker, GF, Sitte, HH & Mihovilovic, MD 2021, 'Effects of Hydroxylated Mephedrone Metabolites on Monoamine Transporter Activity in vitro', Frontiers in Pharmacology, vol. 12, 654061. https://doi.org/10.3389/fphar.2021.654061
Van der Stel, W, Carta, G, Eakins, J, Delp, J, Suciu, I, Forsby, A, Cediel-Ulloa, A, Attoff, K, Troger, F, Kamp, H, Gardner, I, Zdrazil, B, Moné, MJ, Ecker, GF, Pastor, M, Gómez-Tamayo, JC, White, A, Danen, EHJ, Leist, M, Walker, P, Jennings, P, Hougaard Bennekou, S & Van de Water, B 2021, 'New approach methods supporting read-across: Two neurotoxicity AOP-based IATA case studies', Altex, vol. 38, no. 4, pp. 615-635. https://doi.org/10.14573/altex.2103051
Füzi, B, Gurinova, J, Hermjakob, H, Ecker, G & Malik-Sheriff, RS 2021, 'Path4Drug: Data Science Workflow for Identification of Tissue-Specific Biological Pathways Modulated by Toxic Drugs', Frontiers in Pharmacology, vol. 12, 708296. https://doi.org/10.3389/fphar.2021.708296
Cosco, J, Scalise, M, Colas, C, Galluccio, M, Martini, R, Rovella, F, Mazza, T, Ecker, GF & Indiveri, C 2020, 'ATP modulates SLC7A5 (LAT1) synergistically with cholesterol', Scientific Reports, vol. 10, no. 1, 16738, pp. 16738. https://doi.org/10.1038/s41598-020-73757-y
Activities
Showing entries 1 - 5 out of 202
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
Hypothesis generation for variant effects using a KNIME workflow for automatic mapping of disease-related mutations onto 3D protein structures
Jiahui Huang
,
Claire Colas
,
Gerhard Ecker
ACS Fall 2022
Conference,
Poster presentation
21.8.2022 - 21.8.2022