Stefan Gahbauer

8PUBLICATIONS
95CO-AUTHORS
Biomolecular modelling and designBiologically active moleculesCheminformatics and quantitative structure-activity relationshipsNanochemistrySite-based writing
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Publications (8)

|Sep 10, 2024
Extensive exploration of structure activity relationships for the SARS-CoV-2 macrodomain from shape-based fragment merging and active learning.

Galen J Correy, Moira Rachman, Takaya Togo

|Dec 06, 2023
Docking for EP4R antagonists active against inflammatory pain.

Stefan Gahbauer, Chelsea DeLeon, Joao M Braz

|Jan 04, 2023
Iterative computational design and crystallographic screening identifies potent inhibitors targeting the Nsp3 macrodomain of SARS-CoV-2.

Stefan Gahbauer, Galen J Correy, Marion Schuller

|Sep 29, 2022
Structure-based discovery of nonopioid analgesics acting through the α2A-adrenergic receptor.

Elissa A Fink, Jun Xu, Harald Hübner

|Dec 10, 2021
Publisher Correction: A practical guide to large-scale docking.

Brian J Bender, Stefan Gahbauer, Andreas Luttens

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