Chemokines and their receptors: insights from molecular modeling and crystallography

od Kufareva, Irina
Izdano u Curr Opin Pharmacol (2016)

Type-II Kinase Inhibitor Docking, Screening, and Profiling Using Modified Structures of Active Kinase States

od Kufareva, Irina, Abagyan, Ruben
Izdano 2008

The Flexible Pocketome Engine for Structural Chemical Genomics

od Abagyan, Ruben, Kufareva, Irina
Izdano 2009

Methods of protein structure comparison

od Kufareva, Irina, Abagyan, Ruben
Izdano u Methods Mol Biol (2012)

Structure Based Prediction of Subtype-Selectivity for Adenosine Receptor Antagonists

od Katritch, Vsevolod, Kufareva, Irina, Abagyan, Ruben
Izdano 2010

The GAPs, GEFs, GDIs and…now, GEMs: New kids on the heterotrimeric G protein signaling block

od Ghosh, Pradipta, Rangamani, Padmini, Kufareva, Irina
Izdano u Cell Cycle (2017)

Improved docking, screening and selectivity prediction for small molecule nuclear receptor modulators using conformational ensembles

od Park, So-Jung, Kufareva, Irina, Abagyan, Ruben
Izdano 2010

Pocketome: an encyclopedia of small-molecule binding sites in 4D

od Kufareva, Irina, Ilatovskiy, Andrey V., Abagyan, Ruben
Izdano 2012

Quantum Mechanics Approaches to Drug Research in the Era of Structural Chemogenomics

od Ilatovskiy, Andrey V., Abagyan, Ruben, Kufareva, Irina
Izdano u Int J Quantum Chem (2013)

EXPERIMENT-GUIDED MOLECULAR MODELING OF PROTEIN-PROTEIN COMPLEXES INVOLVING GPCRS

od Kufareva, Irina, Handel, Tracy M., Abagyan, Ruben
Izdano u Methods Mol Biol (2015)

A New Method for Ligand Docking to Flexible Receptors by Dual Alanine Scanning and Refinement (SCARE)

od Bottegoni, Giovanni, Kufareva, Irina, Totrov, Maxim, Abagyan, Ruben
Izdano 2008

Four-dimensional Docking: a Fast and Accurate Account of Discrete Receptor Flexibility in Ligand Docking

od Bottegoni, Giovanni, Kufareva, Irina, Totrov, Maxim, Abagyan, Ruben
Izdano 2009

In Silico Identification and Pharmacological Evaluation of Novel Endocrine Disrupting Chemicals That Act via the Ligand-Binding Domain of the Estrogen Receptor α

od McRobb, Fiona M., Kufareva, Irina, Abagyan, Ruben
Izdano u Toxicol Sci (2014)

Chemokine and chemokine receptor structure and interactions: implications for therapeutic strategies

od Kufareva, Irina, Salanga, Catherina L., Handel, Tracy M.
Izdano u Immunol Cell Biol (2015)

Membrane and Protein Interactions of the Pleckstrin Homology Domain Superfamily

od Lenoir, Marc, Kufareva, Irina, Abagyan, Ruben, Overduin, Michael
Izdano u Membranes (Basel) (2015)

PeptiSite: a structural database of peptide binding sites in 4D

od Acharya, Chayan, Kufareva, Irina, Ilatovskiy, Andrey V., Abagyan, Ruben
Izdano 2014

Molecular Mechanisms Deployed by Virally Encoded G Protein Coupled Receptors in Human Diseases

od Montaner, Silvia, Kufareva, Irina, Abagyan, Ruben, Gutkind, J. Silvio
Izdano 2012

Advances in GPCR modeling evaluated by the GPCR Dock 2013 assessment: meeting new challenges

od Kufareva, Irina, Katritch, Vsevolod, Stevens, Raymond C., Abagyan, Ruben
Izdano 2014

Druggable Exosites of the Human Kino-Pocketome

od Nicola, George, Kufareva, Irina, Ilatovskiy, Andrey V., Abagyan, Ruben
Izdano u J Comput Aided Mol Des (2020)

Functional anatomy of the full-length CXCR4-CXCL12 complex systematically dissected by quantitative model-guided mutagenesis

od Stephens, Bryan S., Ngo, Tony, Kufareva, Irina, Handel, Tracy M.
Izdano u Sci Signal (2020)