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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.

Contact Hours for Students

  • Wednesday 14:00 - 15:00
  • Room 2E405 (or online) 
  • only after appointment via E-Mail latest on Friday before
Publications

Demel, M, Krämer, O, Ettmayer, P, Haaksma, E & Ecker, G 2009, 'Predicting Ligand Interactions with ABC Transporters in ADME', Chemistry & Biodiversity, vol. 6, no. 11, pp. 1960-1969.

Hödl, C, Raunegger, K, Strommer, R, Ecker, G, Kunert, O, Sturm, S, Seger, C, Haslinger, E, Steiner, R, Strauss, WSL & Schramm, H-W 2009, 'Synthesis and antigestagenic activity of mifepristone derivatives.', Journal of Medicinal Chemistry, vol. 52, pp. 1268-1274.

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