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Bioinformatics (Oxford, England)
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March 20, 2021
PoseFilter: a PyMOL plugin for filtering and analyzing small molecule docking in symmetric binding sites
Justine C Williams, Subha Kalyaanamoorthy
Journal of Chemical Information and Modeling
|
August 13, 2025
P4ward: An Automated Modeling Platform for Protac Ternary Complexes
Paula Jofily, Subha Kalyaanamoorthy
Journal of Chemical Information and Modeling
|
January 28, 2025
Impact of Phosphorylation and O-GlcNAcylation on the Binding Affinity of R4 Tau Peptide to Microtubule and Its Conformational Preference upon Dissociation
Sathish Dasari, Subha Kalyaanamoorthy
Expert Opinion on Drug Discovery
|
December 15, 2017
Binding modes of hERG blockers: an unsolved mystery in the drug design arena
Subha Kalyaanamoorthy, Khaled H Barakat
Journal of Chemical Information and Modeling
|
January 24, 2012
Exploring inhibitor release pathways in histone deacetylases using random acceleration molecular dynamics simulations
Subha Kalyaanamoorthy, Yi-Ping Phoebe Chen
Medicinal Research Reviews
|
May 4, 2017
Development of Safe Drugs: The hERG Challenge
Subha Kalyaanamoorthy, Khaled H Barakat
Journal of Molecular Graphics & Modelling
|
June 5, 2013
Quantum polarized ligand docking investigation to understand the significance of protonation states in histone deacetylase inhibitors
Subha Kalyaanamoorthy, Yi-Ping Phoebe Chen
Journal of Computational Chemistry
|
July 30, 2013
Ligand release mechanisms and channels in histone deacetylases
Subha Kalyaanamoorthy, Yi-Ping Phoebe Chen
Drug Discovery Today
|
August 4, 2011
Structure-based drug design to augment hit discovery
Subha Kalyaanamoorthy, Yi-Ping Phoebe Chen
Biochimica Et Biophysica Acta
|
March 5, 2013
Energy based pharmacophore mapping of HDAC inhibitors against class I HDAC enzymes
Subha Kalyaanamoorthy, Yi-Ping Phoebe Chen
Page
of 4
Search research articles
Search
Showing results (1-10 of 34) with videos related to
Sort By:
Page
of 4
Bioinformatics (Oxford, England)
|
March 20, 2021
PoseFilter: a PyMOL plugin for filtering and analyzing small molecule docking in symmetric binding sites
Justine C Williams, Subha Kalyaanamoorthy
Journal of Chemical Information and Modeling
|
August 13, 2025
P4ward: An Automated Modeling Platform for Protac Ternary Complexes
Paula Jofily, Subha Kalyaanamoorthy
Journal of Chemical Information and Modeling
|
January 28, 2025
Impact of Phosphorylation and O-GlcNAcylation on the Binding Affinity of R4 Tau Peptide to Microtubule and Its Conformational Preference upon Dissociation
Sathish Dasari, Subha Kalyaanamoorthy
Expert Opinion on Drug Discovery
|
December 15, 2017
Binding modes of hERG blockers: an unsolved mystery in the drug design arena
Subha Kalyaanamoorthy, Khaled H Barakat
Journal of Chemical Information and Modeling
|
January 24, 2012
Exploring inhibitor release pathways in histone deacetylases using random acceleration molecular dynamics simulations
Subha Kalyaanamoorthy, Yi-Ping Phoebe Chen
Medicinal Research Reviews
|
May 4, 2017
Development of Safe Drugs: The hERG Challenge
Subha Kalyaanamoorthy, Khaled H Barakat
Journal of Molecular Graphics & Modelling
|
June 5, 2013
Quantum polarized ligand docking investigation to understand the significance of protonation states in histone deacetylase inhibitors
Subha Kalyaanamoorthy, Yi-Ping Phoebe Chen
Journal of Computational Chemistry
|
July 30, 2013
Ligand release mechanisms and channels in histone deacetylases
Subha Kalyaanamoorthy, Yi-Ping Phoebe Chen
Drug Discovery Today
|
August 4, 2011
Structure-based drug design to augment hit discovery
Subha Kalyaanamoorthy, Yi-Ping Phoebe Chen
Biochimica Et Biophysica Acta
|
March 5, 2013
Energy based pharmacophore mapping of HDAC inhibitors against class I HDAC enzymes
Subha Kalyaanamoorthy, Yi-Ping Phoebe Chen
Page
of 4