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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 96 - 100 out of 314
Richter, L & Ecker, GF 2015, 'Medicinal chemistry in the era of big data', Drug Discovery Today: Technologies, vol. 14, pp. 37-41. https://doi.org/10.1016/j.ddtec.2015.06.001
Montanari, F & Ecker, GF 2015, 'Prediction of drug-ABC-transporter interaction--Recent advances and future challenges', Advanced Drug Delivery Reviews, vol. 86, pp. 17-26. https://doi.org/10.1016/j.addr.2015.03.001
Sanz, F, Carriõ, P, Lõpez, O, Capoferri, L, Kooi, DP, Vermeulen, NPE, Geerke, DP, Montanari, F, Ecker, GF, Schwab, CH, Kleinöder, T, Magdziarz, T & Pastor, M 2015, 'Integrative Modeling Strategies for Predicting Drug Toxicities at the eTOX Project', Molecular Informatics, vol. 34, no. 6-7, pp. 477-484. https://doi.org/10.1002/minf.201400193
Vogensen, SB, Lars, J, Madsen, KK, Jurik, A, Borkar, N, Rosatelli, E, Nielsen, B, Ecker, G, Schousboe, A & Clausen, RP 2015, 'Structure Activity Relationship of selective GABA uptake inhibitors', Bioorganic & Medicinal Chemistry, vol. 23, no. 10, pp. 2480-2488. https://doi.org/10.1016/j.bmc.2015.03.060
Saha, K, Partilla, JS, Lehner, KR, Seddik, A, Stockner, T, Holy, M, Sandtner, W, Ecker, GF, Sitte, HH & Baumann, MH 2015, ''Second Generation' Mephedrone Analogs, 4-MEC and 4-MePPP, Differentially Affect Monoamine Transporter Function', Neuropsychopharmacology : official publication of the American College of Neuropsychopharmacology, vol. 40, no. 6, pp. 1321-1331. https://doi.org/10.1038/npp.2014.325
Activities
Showing entries 1 - 5 out of 205
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
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