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James B Dunbar

Showing results (1-10 of 16) with videos related to

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Journal of Chemical Information and Modeling|September 28, 2011
A call to arms: what you can do for computational drug discoveryHeather A Carlson, James B Dunbar
Journal of Chemical Information and Computer Sciences|March 26, 2003
CLIP: similarity searching of 3D databases using clique detectionNicholas Rhodes, Peter Willett, Alain Calvet, et al.
Journal of Chemical Information and Modeling|June 21, 2012
Biophysical limits of protein-ligand bindingRichard D Smith, Alaina L Engdahl, James B Dunbar, et al.
Journal of Medicinal Chemistry|July 26, 2014
An allosteric modulator of HIV-1 protease shows equipotent inhibition of wild-type and drug-resistant proteasesPeter M-U Ung, James B Dunbar, Jason E Gestwicki, et al.
Nucleic Acids Research|November 8, 2014
Recent improvements to Binding MOAD: a resource for protein-ligand binding affinities and structuresAqeel Ahmed, Richard D Smith, Jordan J Clark, et al.
Journal of Chemical Information and Modeling|April 4, 2013
CSAR benchmark exercise 2011-2012: evaluation of results from docking and relative ranking of blinded congeneric seriesKelly L Damm-Ganamet, Richard D Smith, James B Dunbar, et al.
Journal of Molecular Biology|May 25, 2019
Updates to Binding MOAD (Mother of All Databases): Polypharmacology Tools and Their Utility in Drug RepurposingRichard D Smith, Jordan J Clark, Aqeel Ahmed, et al.
Journal of Medicinal Chemistry|October 2, 2008
Differences between high- and low-affinity complexes of enzymes and nonenzymesHeather A Carlson, Richard D Smith, Nickolay A Khazanov, et al.
Journal of Chemical Information and Modeling|August 4, 2011
CSAR benchmark exercise of 2010: combined evaluation across all submitted scoring functionsRichard D Smith, James B Dunbar, Peter Man-Un Ung, et al.
Journal of Chemical Information and Modeling|July 7, 2011
CSAR benchmark exercise of 2010: selection of the protein-ligand complexesJames B Dunbar, Richard D Smith, Chao-Yie Yang, et al.
Pageof 2

Showing results (1-10 of 16) with videos related to

Sort By:
Pageof 2
Journal of Chemical Information and Modeling|September 28, 2011
A call to arms: what you can do for computational drug discoveryHeather A Carlson, James B Dunbar
Journal of Chemical Information and Computer Sciences|March 26, 2003
CLIP: similarity searching of 3D databases using clique detectionNicholas Rhodes, Peter Willett, Alain Calvet, et al.
Journal of Chemical Information and Modeling|June 21, 2012
Biophysical limits of protein-ligand bindingRichard D Smith, Alaina L Engdahl, James B Dunbar, et al.
Journal of Medicinal Chemistry|July 26, 2014
An allosteric modulator of HIV-1 protease shows equipotent inhibition of wild-type and drug-resistant proteasesPeter M-U Ung, James B Dunbar, Jason E Gestwicki, et al.
Nucleic Acids Research|November 8, 2014
Recent improvements to Binding MOAD: a resource for protein-ligand binding affinities and structuresAqeel Ahmed, Richard D Smith, Jordan J Clark, et al.
Journal of Chemical Information and Modeling|April 4, 2013
CSAR benchmark exercise 2011-2012: evaluation of results from docking and relative ranking of blinded congeneric seriesKelly L Damm-Ganamet, Richard D Smith, James B Dunbar, et al.
Journal of Molecular Biology|May 25, 2019
Updates to Binding MOAD (Mother of All Databases): Polypharmacology Tools and Their Utility in Drug RepurposingRichard D Smith, Jordan J Clark, Aqeel Ahmed, et al.
Journal of Medicinal Chemistry|October 2, 2008
Differences between high- and low-affinity complexes of enzymes and nonenzymesHeather A Carlson, Richard D Smith, Nickolay A Khazanov, et al.
Journal of Chemical Information and Modeling|August 4, 2011
CSAR benchmark exercise of 2010: combined evaluation across all submitted scoring functionsRichard D Smith, James B Dunbar, Peter Man-Un Ung, et al.
Journal of Chemical Information and Modeling|July 7, 2011
CSAR benchmark exercise of 2010: selection of the protein-ligand complexesJames B Dunbar, Richard D Smith, Chao-Yie Yang, et al.
Pageof 2