| A practical guide to large-scale docking BJ Bender, S Gahbauer, A Luttens, J Lyu, CM Webb, RM Stein, EA Fink, ... Nature protocols 16 (10), 4799-4832, 2021 | 267 | 2021 |
| Membrane-mediated oligomerization of G protein coupled receptors and its implications for GPCR function S Gahbauer, RA Böckmann Frontiers in physiology 7, 226635, 2016 | 130 | 2016 |
| Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking M Schuller, GJ Correy, S Gahbauer, D Fearon, T Wu, RE Díaz, ID Young, ... Science advances 7 (16), eabf8711, 2021 | 127 | 2021 |
| Dynamic cholesterol-conditioned dimerization of the G protein coupled chemokine receptor type 4 K Pluhackova, S Gahbauer, F Kranz, TA Wassenaar, RA Böckmann PLoS computational biology 12 (11), e1005169, 2016 | 85 | 2016 |
| Structure-based discovery of nonopioid analgesics acting through the α2A-adrenergic receptor EA Fink, J Xu, H Hübner, JM Braz, P Seemann, C Avet, V Craik, D Weikert, ... Science 377 (6614), eabn7065, 2022 | 65 | 2022 |
| Iterative computational design and crystallographic screening identifies potent inhibitors targeting the Nsp3 macrodomain of SARS-CoV-2 S Gahbauer, GJ Correy, M Schuller, MP Ferla, YU Doruk, M Rachman, ... Proceedings of the National Academy of Sciences 120 (2), e2212931120, 2023 | 49 | 2023 |
| Closely related, yet unique: Distinct homo-and heterodimerization patterns of G protein coupled chemokine receptors and their fine-tuning by cholesterol S Gahbauer, K Pluhackova, RA Böckmann PLoS Computational Biology 14 (3), e1006062, 2018 | 43 | 2018 |
| Oxidative stress-induced STIM2 cysteine modifications suppress store-operated calcium entry CS Gibhardt, S Cappello, R Bhardwaj, R Schober, SA Kirsch, ZB Del Rio, ... Cell reports 33 (3), 2020 | 28 | 2020 |
| The mechanisms of catalysis and ligand binding for the SARS-CoV-2 NSP3 macrodomain from neutron and x-ray diffraction at room temperature GJ Correy, DW Kneller, G Phillips, S Pant, S Russi, AE Cohen, G Meigs, ... Science advances 8 (21), eabo5083, 2022 | 26 | 2022 |
| Comprehensive characterization of lipid-guided G protein-coupled receptor dimerization S Gahbauer, RA Böckmann The Journal of Physical Chemistry B 124 (14), 2823-2834, 2020 | 21 | 2020 |
| Large library docking for novel SARS‐CoV‐2 main protease non‐covalent and covalent inhibitors EA Fink, C Bardine, S Gahbauer, I Singh, TC Detomasi, K White, S Gu, ... Protein Science 32 (8), e4712, 2023 | 10 | 2023 |
| Structure-based inhibitor optimization for the Nsp3 Macrodomain of SARS-CoV-2. S Gahbauer, GJ Correy, M Schuller, MP Ferla, YU Doruk, M Rachman, ... Biorxiv: the Preprint Server for Biology, 2022 | 3 | 2022 |
| Publisher Correction: A practical guide to large-scale docking BJ Bender, S Gahbauer, A Luttens, J Lyu, CM Webb, RM Stein, EA Fink, ... Nature protocols 17 (1), 177, 2022 | 2 | 2022 |
| Docking for EP4R antagonists active against inflammatory pain S Gahbauer, C DeLeon, JM Braz, V Craik, HJ Kang, X Wan, XP Huang, ... Nature Communications 14 (1), 8067, 2023 | 1 | 2023 |
| Homo-and heterodimerization of G protein coupled chemokine receptors S Gahbauer, K Pluhackova, RA Bockmann Eur. Biophys. J. Biophys. Lett 46, S375, 2017 | 1 | 2017 |
| Fragmenstein: predicting protein-ligand structures of compounds derived from known crystallographic fragment hits using a strict conserved-binding–based methodology MP Ferla, R Sánchez-García, RE Skyner, S Gahbauer, JC Taylor, ... | | 2024 |
| Structure-Based Discovery of a NPFF1R Antagonist with Analgesic Activity BJ Bender, JE Pickett, J Braz, HJ Kang, S Gahbauer, K Bhardwaj, ... bioRxiv, 2023.10. 25.564029, 2023 | | 2023 |
| Structure-based inhibitor optimization for the Nsp3 Macrodomain of SARS-CoV-2 (preprint) S Gahbauer, GJ Correy, M Schuller, MP Ferla, YU Doruk, M Rachman, ... | | 2022 |
| Large library docking for novel SARS-CoV-2 main protease non-covalent and covalent inhibitors (preprint) E Fink, C Bardine, S Gahbauer, I Singh, K White, S Gu, X Wan, B Ary, ... | | 2022 |
| The mechanisms of catalysis and ligand binding for the SARS-CoV-2 NSP3 macrodomain from neutron and X-ray diffraction at room temperature (preprint) GJ Correy, DW Kneller, G Phillips, S Pant, S Russi, AE Cohen, G Meigs, ... | | 2022 |
Brian ShoichetProfessor of Pharmaceutical Chemistry, University of California, San FranciscoVerified email at cgl.ucsf.edu
