List of works - Govindan Subramanian

4 Molecular Modeling of Opioid Receptor-Ligand Complexes

A diboracyclopropane with a planar-tetracoordinate carbon atom and a triborabicyclobutane.

scientific article

Allosteric antagonist binding sites in class B GPCRs: corticotropin receptor 1.

scientific article

An integrated computational workflow for efficient and quantitative modeling of renin inhibitors ⬇️

scientific article published on December 7, 2011

Comprehending renin inhibitor's binding affinity using structure-based approaches

scientific article

Computational Modeling of Kinase Inhibitor Selectivity

scientific article published on 28 July 2010

Computational Modeling of β-Secretase 1 (BACE-1) Inhibitors Using Ligand Based Approaches.

scientific article

Computational approaches for modeling human intestinal absorption and permeability.

scientific article published on April 2006

Computational modeling and design of renin inhibitors.

scientific article

Computational models to predict blood-brain barrier permeation and CNS activity

scientific article published on 01 October 2003

Connecting the conformational behavior of cyclic octadepsipeptides with their ionophoric property and membrane permeability

scientific article published on 09 September 2020

Deciphering the Allosteric Binding Mechanism of the Human Tropomyosin Receptor Kinase A ( hTrkA) Inhibitors

scientific article published on 14 May 2019

In silico ligand-based modeling of hBACE-1 inhibitors.

scientific article published on 15 November 2017

Integrated approaches to perform in silico drug discovery

scientific article published in September 2006

Lead identification and characterization of hTrkA type 2 inhibitors

scientific article published on 13 September 2019

Molecular docking reveals a novel binding site model for fentanyl at the mu-opioid receptor.

scientific article

Potent and selective indolomorphinan antagonists of the kappa-opioid receptor

scientific article (publication date: 13 July 2000)

List of works by Govindan Subramanian

4 Molecular Modeling of Opioid Receptor-Ligand Complexes

A diboracyclopropane with a planar-tetracoordinate carbon atom and a triborabicyclobutane.

Allosteric antagonist binding sites in class B GPCRs: corticotropin receptor 1.

An integrated computational workflow for efficient and quantitative modeling of renin inhibitors ⬇️

Comprehending renin inhibitor's binding affinity using structure-based approaches

Computational Modeling of Kinase Inhibitor Selectivity

Computational Modeling of β-Secretase 1 (BACE-1) Inhibitors Using Ligand Based Approaches.

Computational approaches for modeling human intestinal absorption and permeability.

Computational modeling and design of renin inhibitors.

Computational models to predict blood-brain barrier permeation and CNS activity

Connecting the conformational behavior of cyclic octadepsipeptides with their ionophoric property and membrane permeability

Deciphering the Allosteric Binding Mechanism of the Human Tropomyosin Receptor Kinase A ( hTrkA) Inhibitors

In silico ligand-based modeling of hBACE-1 inhibitors.

Integrated approaches to perform in silico drug discovery

Lead identification and characterization of hTrkA type 2 inhibitors

Molecular docking reveals a novel binding site model for fentanyl at the mu-opioid receptor.

Potent and selective indolomorphinan antagonists of the kappa-opioid receptor