Albina Bolotokova

Toronto, ON M5G2C4, Canada

Last Updated: 09/26/2026

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Found 23 publications

CACHE Challenge #3: Targeting the Nsp3 Macrodomain of SARS-CoV-2.

CACHE Challenge #3: Targeting the Nsp3 Macrodomain of SARS-CoV-2.

Journal: Journal of chemical information and modeling
Published: January 21, 2026

Enabling Open Machine Learning of Deoxyribonucleic Acid-Encoded Library Selections to Accelerate the Discovery of Small Molecule Protein Binders.

Enabling Open Machine Learning of Deoxyribonucleic Acid-Encoded Library Selections to Accelerate the Discovery of Small Molecule Protein Binders.

Journal: Journal of medicinal chemistry
Published: October 06, 2025

Structure-based discovery of inhibitors of Mac1 domain of nonstructural protein-3 of SARS-CoV-2 by machine learning-augmented screening of chemical space.

Structure-based discovery of inhibitors of Mac1 domain of nonstructural protein-3 of SARS-CoV-2 by machine learning-augmented screening of chemical space.

Journal: bioRxiv : the preprint server for biology
Published: September 18, 2025

CACHE Challenge #2: Targeting the RNA Site of the SARS-CoV-2 Helicase Nsp13.

CACHE Challenge #2: Targeting the RNA Site of the SARS-CoV-2 Helicase Nsp13.

Journal: Journal of chemical information and modeling
Published: June 20, 2025

Active Learning-Guided Hit Optimization for the Leucine-Rich Repeat Kinase 2 WDR Domain Based on In Silico Ligand-Binding Affinities.

Active Learning-Guided Hit Optimization for the Leucine-Rich Repeat Kinase 2 WDR Domain Based on In Silico Ligand-Binding Affinities.

Journal: Journal of chemical information and modeling
Published: May 26, 2025

Enantioselective protein affinity selection mass spectrometry (E-ASMS).

Enantioselective protein affinity selection mass spectrometry (E-ASMS).

Journal: Nature communications
Published: February 06, 2025

Enantioselective Protein Affinity Selection Mass Spectrometry (E-ASMS).

Enantioselective Protein Affinity Selection Mass Spectrometry (E-ASMS).

Journal: bioRxiv : the preprint server for biology
Published: February 03, 2025

Functionally active modulators targeting the LRRK2 WD40 repeat domain identified by FRASE-bot in CACHE Challenge #1.

Functionally active modulators targeting the LRRK2 WD40 repeat domain identified by FRASE-bot in CACHE Challenge #1.

Journal: Chemical science
Published: November 07, 2024

CACHE Challenge #1: Targeting the WDR Domain of LRRK2, A Parkinson's Disease Associated Protein.

CACHE Challenge #1: Targeting the WDR Domain of LRRK2, A Parkinson's Disease Associated Protein.

Journal: Journal of chemical information and modeling
Published: November 05, 2024

A Target Class Ligandability Evaluation of WD40 Repeat-Containing Proteins.

A Target Class Ligandability Evaluation of WD40 Repeat-Containing Proteins.

Journal: Journal of medicinal chemistry
Published: November 04, 2024

Subpocket Similarity-Based Hit Identification for Challenging Targets: Application to the WDR Domain of LRRK2.

Subpocket Similarity-Based Hit Identification for Challenging Targets: Application to the WDR Domain of LRRK2.

Journal: Journal of chemical information and modeling
Published: June 25, 2024

Discovery of a First-in-Class Small-Molecule Ligand for WDR91 Using DNA-Encoded Chemical Library Selection Followed by Machine Learning.

Discovery of a First-in-Class Small-Molecule Ligand for WDR91 Using DNA-Encoded Chemical Library Selection Followed by Machine Learning.

Journal: Journal of medicinal chemistry
Published: November 23, 2023
Showing 1-12 of 23

Last Updated: 09/26/2026