EUROPIN Summer School on Drug Design – Vienna
September 14 – 19, 2025
Agenda
Please note: Our website is under construction and will therefore be updated regularly.
Sunday, 14.09.2025
| 16:00 | Registration | |
| 18:00 | Welcome & Introduction | |
| 18:15 | Kirchmair, Johannes University of Vienna |
Methods and Strategies for Tackling Assay Interference Caused by Small Molecules |
| 19:00 | Get-together |
Monday, 15.09.2025
| 09:00 | ||
| 09:30 | ||
| 10:00 | Coffee Break | |
| 10:30 | ||
| 11:00 | ||
| 11:30 | Julia Kandler University of Vienna |
Investigating Developmental Neurotoxicity: Integrated Models of Thyroid Function Disruption |
| 11:45 | ||
| 12:00 | Lunch Break | |
| 14:00 | ||
| 14:30 | Workshops | |
| 16:30 | Coffee Break | |
| 17:00 | ||
| 17:15 | Hosein Fooladi University of Vienna |
Bridging Islands in Chemical Space: Evaluating and Enhancing ML Generalization for Drug Discovery |
| 17:30 | Poster Session |
Tuesday, 16.09.2025
| 09:00 | Stefan Boresch University of Vienna |
Setting up MD Simulations of Biomolecules |
| 09:30 | Stefan Boresch University of Vienna |
An Introduction to Alchemical Free Energy Simulations |
| 10:00 | Coffee Break | |
| 10:30 | ||
| 11:00 | Anna Weinzinger University of Vienna |
Ion Channels in Health and Disease: From Mechanistic Understanding to Therapeutic Solutions |
| 11:30 | ||
| 12:00 | Lunch Break | |
| 14:00 | ||
| 14:30 | Workshops | |
| 16:30 | Coffee Break | |
| 17:00 | ||
| 17:15 | ||
| 17:30 | Mireille Krier OpenEye, Cadence Molecular Sciences |
A Molecular Modeling Smorgasbord |
Wednesday, 17.09.2025
| 09:00 | ||
| 09:30 | ||
| 10:00 | Coffee Break | |
| 10:30 | ||
| 11:00 | ||
| 11:30 | Sara Tkaczyk University of Vienna |
Title to be announced |
| 11:45 | ||
| 12:00 | Lunch Break | |
| 14:00 | Marcus Gastreich BioSolveIT |
0D, 2D, and 3D Navigation of Zetta-sized On-Demand Chemical Spaces |
| 14:30 | Workshops | BioSolveIT 1 |
| 16:30 | Coffee Break | |
| 17:00 | ||
| 17:15 | ||
| 17:30 | Poster Session |
Thursday, 18.09.2025
| 09:00 | Sergey Sosnin University of Vienna |
Title to be announced |
| 09:30 | ||
| 10:00 | Coffee Break | |
| 10:30 | ||
| 11:00 | ||
| 11:30 | ||
| 11:45 | Friederike Wunsch University of Münster |
Dynamics shaping GPCRs‘ functionality |
| 12:00 | Lunch Break | |
| 14:00 | ||
| 14:30 | Workshops | BioSolveIT 2 |
| 16:30 | Coffee Break | |
| 17:00 | Hans-Dieter Höltje Heinrich-Heine-University Düsseldorf |
Early results of theoretical investigations at the dawn of Computer-assisted Drug Design |
| 19:00 | Congress Dinner |
Friday, 19.09.2025
| 09:00 | Peter Ettmayer Boehringer-Ingelheim |
Drug Discovery MythBusters |
| 09:30 | ||
| 10:00 | Coffee Break | |
| 10:30 | ||
| 11:00 | ||
| 11:30 | ||
| 14:00 | EUROPIN |
Contact us
If you have any questions regarding the EUROPIN Summer School on Drug Design, please don’t hesitate to contact us.
EUROPIN – a structured, highly interconnected training through research PhD program on the efficient and innovative use of information technologies and computational approaches in the drug discovery, design and development processes.
Organised by
Pharmacoinformatics Research Group
Following a holistic pharmacoinformatic approach we combine structural modeling of proteins, structure-based drug design, chemometric and in silico chemogenomic methods, statistical modeling and machine learning approaches to develop predictive computational systems for transporters and ion channels.
The validation and optimisation of the obtained in silico models by strong links to experimental groups is an integral part of these activities.