Sandhya Kortagere

发表

Applications and limitations of in silico models in drug discovery.

Ahmet Sacan, Sean Ekins, Sandhya Kortagere, 2012, Methods in molecular biology.

Challenges Predicting Ligand-Receptor Interactions of Promiscuous Proteins: The Nuclear Receptor PXR

Sean Ekins, Sandhya Kortagere, Matthew D. Krasowski, 2009, PLoS Comput. Biol..

Ab initio computational modeling of long loops in G-protein coupled receptors

Sandhya Kortagere, Amitava Roy, Ernest L. Mehler, 2006, J. Comput. Aided Mol. Des..

Development and application of hybrid structure based method for efficient screening of ligands binding to G-protein coupled receptors

William J. Welsh, Sandhya Kortagere, W. Welsh, 2007, J. Comput. Aided Mol. Des..

Structure–Activity Relationships of a Novel Capsid Targeted Inhibitor of HIV-1 Replication

Sandhya Kortagere, Roger G. Ptak, Jimmy P. Xu, 2014, J. Chem. Inf. Model..

Role of computational methods in pharmaceutical sciences.

Sandhya Kortagere, Markus Lill, John Kerrigan, 2012, Methods in molecular biology.

Structure-based Design of Novel Small-Molecule Inhibitors of Plasmodium falciparum

William J. Welsh, Sandhya Kortagere, Thomas Daly, 2010, J. Chem. Inf. Model..

Rapid discovery of inhibitors of Toxoplasma gondii using hybrid structure-based computational approach

William J. Welsh, Sandhya Kortagere, Ernest Mui, 2011, J. Comput. Aided Mol. Des..

Pyrazoleamide compounds are potent antimalarials that target Na+ homeostasis in intraerythrocytic Plasmodium falciparum

Sandhya Kortagere, Thomas D. Otto, Vicky M. Avery, 2014, Nature Communications.

Hybrid Scoring and Classification Approaches to Predict Human Pregnane X Receptor Activators

William J. Welsh, Sean Ekins, Sandhya Kortagere, 2009, Pharmaceutical Research.

The importance of discerning shape in molecular pharmacology.

Sean Ekins, Sandhya Kortagere, Matthew D Krasowski, 2009, Trends in pharmacological sciences.

In Silico Models for Drug Discovery

Sandhya Kortagere, S. Kortagere, 2013, Methods in Molecular Biology.

Troubleshooting computational methods in drug discovery.

Sean Ekins, Sandhya Kortagere, S. Ekins, 2010, Journal of pharmacological and toxicological methods.

Certain 1,4-Disubstituted Aromatic Piperidines and Piperazines with Extreme Selectivity for the Dopamine D4 Receptor Interact with a Common Receptor Microdomain

Peter Gmeiner, Sandhya Kortagere, Harel Weinstein, 2004, Molecular Pharmacology.

Ab initio computational modeling of loops in G‐protein‐coupled receptors: Lessons from the crystal structure of rhodopsin

Sergio A Hassan, Sandhya Kortagere, Harel Weinstein, 2006, Proteins.

Symbiotic Bacterial Metabolites Regulate Gastrointestinal Barrier Function via the Xenobiotic Sensor PXR and Toll‐like Receptor 4

Sandhya Kortagere, Jeremy K Nicholson, Hongwei Wang, 2014, Immunity.

Reciprocal Mutations in TM2/TM3 in a D2 Dopamine Receptor Background Confirms the Importance of this Microdomain as a Selective Determinant of Para‐Halogenated 1,4‐Disubstituted Aromatic Piperazines

Sandhya Kortagere, S. Kortagere, Christina Z Floresca, 2005, Archiv der Pharmazie.

Halogenated ligands and their interactions with amino acids: implications for structure-activity and structure-toxicity relationships.

William J. Welsh, Sean Ekins, Sandhya Kortagere, 2008, Journal of molecular graphics & modelling.