Irina Kufareva

According to our database, Irina Kufareva authored at least 9 papers between 2008 and 2023.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2023

kboolnet: a toolkit for the verification, validation, and visualization of reaction-contingency (rxncon) models.

Willow Carretero Chavez, Marcus Krantz, Edda Klipp, Irina Kufareva

BMC Bioinform., December, 2023

2020

Druggable exosites of the human kino-pocketome.

George Nicola, Irina Kufareva, Andrey V. Ilatovskiy, Ruben Abagyan

J. Comput. Aided Mol. Des., 2020

2015

Structure-Based Predictions of Activity Cliffs.

Jarmila Husby, Giovanni Bottegoni, Irina Kufareva, Ruben Abagyan, Andrea Cavalli

J. Chem. Inf. Model., 2015

2014

Identification of Novel Serotonin Transporter Compounds by Virtual Screening.

Mari Gabrielsen, Rafal Kurczab, Agata Siwek, Malgorzata Wolak, Aina Westrheim Ravna, Kurt Kristiansen, Irina Kufareva, Ruben Abagyan, Gabriel Nowak, Zdzislaw Chilmonczyk, Ingebrigt Sylte, Andrzej J. Bojarski

J. Chem. Inf. Model., 2014

2012

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

Irina Kufareva, Andrey V. Ilatovskiy, Ruben Abagyan

Nucleic Acids Res., 2012

2010

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

So-Jung Park, Irina Kufareva, Ruben Abagyan

J. Comput. Aided Mol. Des., 2010

Spatial chemical distance based on atomic property fields.

A. V. Grigoryan, Irina Kufareva, Maxim Totrov, Ruben Abagyan

J. Comput. Aided Mol. Des., 2010

2008

Optimization of High Throughput Virtual Screening by Combining Shape-Matching and Docking Methods.

Hui Sun Lee, Jiwon Choi, Irina Kufareva, Ruben Abagyan, Anton V. Filikov, Young Yang, Sukjoon Yoon

J. Chem. Inf. Model., 2008

A new method for ligand docking to flexible receptors by dual alanine scanning and refinement (SCARE).

Giovanni Bottegoni, Irina Kufareva, Maxim Totrov, Ruben Abagyan

J. Comput. Aided Mol. Des., 2008