Brian K. Shoichet, Ph.D.
Affiliations: | 1996-2002 | Chemistry | Northwestern University, Evanston, IL |
2002- | Chemistry | University of California, San Francisco, San Francisco, CA |
Area:
GPCR, computational chemistryWebsite:
http://shoichetlab.compbio.ucsf.edu/Google:
"Brian Kenton Shoichet"Bio:
https://books.google.com/books?id=e_e2c1XKEEgC
Mean distance: 8.73 | S | N | B | C | P |
Parents
Sign in to add mentorIrwin D. TackKuntz |
grad student | 1991 | UCSF | |
(Molecular Docking: Theory and Application to Recognition and Inhibitor Design.) | ||||
Brian W. Matthews | post-doc | University of Oregon |
Children
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Publications
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Smith ST, Cassada JB, Von Bredow L, et al. (2024) Discovery of Protease-Activated Receptor 4 (PAR4)-Tethered Ligand Antagonists Using Ultralarge Virtual Screening. Acs Pharmacology & Translational Science. 7: 1086-1100 |
Smith MS, Knight IS, Kormos RC, et al. (2024) Docking for Molecules That Bind in a Symmetric Stack with SymDOCK. Journal of Chemical Information and Modeling |
Liu F, Wu CG, Tu CL, et al. (2023) Structure-based discovery of positive allosteric modulators for the calcium sensing receptor. Biorxiv : the Preprint Server For Biology |
Lyu J, Kapolka N, Gumpper R, et al. (2023) AlphaFold2 structures template ligand discovery. Biorxiv : the Preprint Server For Biology |
Smith MS, Knight IS, Kormos RC, et al. (2023) Docking for molecules that bind in a symmetric stack with SymDOCK. Biorxiv : the Preprint Server For Biology |
Gahbauer S, Correy GJ, Schuller M, et al. (2023) Iterative computational design and crystallographic screening identifies potent inhibitors targeting the Nsp3 macrodomain of SARS-CoV-2. Proceedings of the National Academy of Sciences of the United States of America. 120: e2212931120 |
Fink EA, Xu J, Hübner H, et al. (2022) Structure-based discovery of nonopioid analgesics acting through the α-adrenergic receptor. Science (New York, N.Y.). 377: eabn7065 |
Gahbauer S, Correy GJ, Schuller M, et al. (2022) Structure-based inhibitor optimization for the Nsp3 Macrodomain of SARS-CoV-2. Biorxiv : the Preprint Server For Biology |
Bender BJ, Gahbauer S, Luttens A, et al. (2021) Publisher Correction: A practical guide to large-scale docking. Nature Protocols |
Alon A, Lyu J, Braz JM, et al. (2021) Structures of the σ receptor enable docking for bioactive ligand discovery. Nature |