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Journal of the American Chemical Society
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May 18, 2013
Ligand-dependent activation and deactivation of the human adenosine A(2A) receptor
Jianing Li, Amanda L Jonsson, Thijs Beuming, et al.
Neurochemistry International
|
March 1, 2014
Conformational changes in dopamine transporter intracellular regions upon cocaine binding and dopamine translocation
Yvette Dehnes, Jufang Shan, Thijs Beuming, et al.
Pharmacological Reviews
|
December 21, 2014
What can crystal structures of aminergic receptors tell us about designing subtype-selective ligands?
Mayako Michino, Thijs Beuming, Prashant Donthamsetti, et al.
Journal of Chemical Information and Modeling
|
June 17, 2020
Rigorous Free Energy Simulations in Virtual Screening
Zoe Cournia, Bryce K Allen, Thijs Beuming, et al.
Journal of Chemical Information and Modeling
|
September 13, 2022
Are Deep Learning Structural Models Sufficiently Accurate for Free-Energy Calculations? Application of FEP+ to AlphaFold2-Predicted Structures
Thijs Beuming, Helena Martín, Anna M Díaz-Rovira, et al.
Journal of Chemical Information and Modeling
|
March 9, 2023
Are Deep Learning Structural Models Sufficiently Accurate for Virtual Screening? Application of Docking Algorithms to AlphaFold2 Predicted Structures
Anna M Díaz-Rovira, Helena Martín, Thijs Beuming, et al.
Journal of Chemical Information and Modeling
|
May 20, 2014
Selecting an optimal number of binding site waters to improve virtual screening enrichments against the adenosine A2A receptor
Eelke B Lenselink, Thijs Beuming, Woody Sherman, et al.
European Journal of Pharmacology
|
November 13, 2003
Probing conformational changes in neurotransmitter transporters: a structural context
Naomi R Goldberg, Thijs Beuming, Orkun S Soyer, et al.
The Journal of Physical Chemistry. B
|
November 15, 2014
Docking and free energy perturbation studies of ligand binding in the kappa opioid receptor
Dahlia A Goldfeld, Robert Murphy, Byungchan Kim, et al.
Journal of Chemical Information and Modeling
|
December 28, 2016
Relative Binding Free Energy Calculations Applied to Protein Homology Models
Daniel Cappel, Michelle Lynn Hall, Eelke B Lenselink, et al.
Page
of 5
Search research articles
Search
Showing results (21-30 of 50) with videos related to
Sort By:
Page
of 5
Journal of the American Chemical Society
|
May 18, 2013
Ligand-dependent activation and deactivation of the human adenosine A(2A) receptor
Jianing Li, Amanda L Jonsson, Thijs Beuming, et al.
Neurochemistry International
|
March 1, 2014
Conformational changes in dopamine transporter intracellular regions upon cocaine binding and dopamine translocation
Yvette Dehnes, Jufang Shan, Thijs Beuming, et al.
Pharmacological Reviews
|
December 21, 2014
What can crystal structures of aminergic receptors tell us about designing subtype-selective ligands?
Mayako Michino, Thijs Beuming, Prashant Donthamsetti, et al.
Journal of Chemical Information and Modeling
|
June 17, 2020
Rigorous Free Energy Simulations in Virtual Screening
Zoe Cournia, Bryce K Allen, Thijs Beuming, et al.
Journal of Chemical Information and Modeling
|
September 13, 2022
Are Deep Learning Structural Models Sufficiently Accurate for Free-Energy Calculations? Application of FEP+ to AlphaFold2-Predicted Structures
Thijs Beuming, Helena Martín, Anna M Díaz-Rovira, et al.
Journal of Chemical Information and Modeling
|
March 9, 2023
Are Deep Learning Structural Models Sufficiently Accurate for Virtual Screening? Application of Docking Algorithms to AlphaFold2 Predicted Structures
Anna M Díaz-Rovira, Helena Martín, Thijs Beuming, et al.
Journal of Chemical Information and Modeling
|
May 20, 2014
Selecting an optimal number of binding site waters to improve virtual screening enrichments against the adenosine A2A receptor
Eelke B Lenselink, Thijs Beuming, Woody Sherman, et al.
European Journal of Pharmacology
|
November 13, 2003
Probing conformational changes in neurotransmitter transporters: a structural context
Naomi R Goldberg, Thijs Beuming, Orkun S Soyer, et al.
The Journal of Physical Chemistry. B
|
November 15, 2014
Docking and free energy perturbation studies of ligand binding in the kappa opioid receptor
Dahlia A Goldfeld, Robert Murphy, Byungchan Kim, et al.
Journal of Chemical Information and Modeling
|
December 28, 2016
Relative Binding Free Energy Calculations Applied to Protein Homology Models
Daniel Cappel, Michelle Lynn Hall, Eelke B Lenselink, et al.
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of 5