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Brian K. Shoichet, Ph.D.

1996-2002 Chemistry Northwestern University, Evanston, IL 
 2002- Chemistry University of California, San Francisco, San Francisco, CA 
GPCR, computational chemistry
"Brian Kenton Shoichet"

Mean distance: 8.73


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Irwin D. Tack Kuntz grad student 1991 UCSF
 (Molecular Docking: Theory and Application to Recognition and Inhibitor Design.)
Brian W. Matthews post-doc University of Oregon


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Andrew I. Su research assistant 1996-1998 Northwestern University Medical School
David M. Lorber grad student 2001 Northwestern
Beth M. Beadle grad student 2002 Northwestern
Rachel A. Powers grad student 2002 Northwestern
Susan L. McGovern grad student 2003 Northwestern
Binqing Wei grad student 2003 Northwestern
Brian Y. Feng grad student 2007 UCSF
Alan P. Graves grad student 2007 UCSF
Kristin Emily Coan grad student 2008 UCSF
Sarah E. Boyce grad student 2009 UCSF
Michael J. Keiser grad student 2009 UCSF
Veena L. Thomas grad student 2009 UCSF
Rafaela S. Ferreira grad student 2010 UCSF
Michael M. Mysinger grad student 2012 UCSF
Gabriel J. Rocklin grad student 2013 UCSF
Jens Carlsson post-doc UCSF
Niu Huang post-doc
Marcus Fischer post-doc 2011- UCSF
Sarah Barelier post-doc 2013- UCSF
Anat Levit post-doc 2013- UCSF
Trent Balius post-doc 2014- UCSF
James R. Horn post-doc 2002-2003 Northwestern
Peter Kolb post-doc 2007-2011 UCSF
Matthew J. O'Meara post-doc 2013-2019 University of California San Francisco and Gladstone Institutes (Computer Science Tree)
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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
Cheng Y, Feng S, Puchades C, et al. (2022) Identification of a conserved drug binding pocket in TMEM16 proteins. Research Square
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
Bender BJ, Gahbauer S, Luttens A, et al. (2021) A practical guide to large-scale docking. Nature Protocols
Kamenik AS, Singh I, Lak P, et al. (2021) Energy penalties enhance flexible receptor docking in a model cavity. Proceedings of the National Academy of Sciences of the United States of America. 118
Tummino TA, Rezelj VV, Fischer B, et al. (2021) Drug-induced phospholipidosis confounds drug repurposing for SARS-CoV-2. Science (New York, N.Y.). 373: 541-547
Schuller M, Correy GJ, Gahbauer S, et al. (2021) Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Science Advances. 7
Tummino TA, Rezelj VV, Fischer B, et al. (2021) Phospholipidosis is a shared mechanism underlying the antiviral activity of many repurposed drugs against SARS-CoV-2. Biorxiv : the Preprint Server For Biology
Lak P, O'Donnell H, Du X, et al. (2021) A Crowding Barrier to Protein Inhibition in Colloidal Aggregates. Journal of Medicinal Chemistry
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