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Molecular Informatics|March 18, 2025
CoLiNN: A Tool for Fast Chemical Space Visualization of Combinatorial Libraries Without EnumerationRegina Pikalyova, Tagir Akhmetshin, Dragos Horvath, et al.Journal of Chemical Information and Modeling|December 31, 2024
SynPlanner: An End-to-End Tool for Synthesis PlanningTagir Akhmetshin, Dmitry Zankov, Philippe Gantzer, et al.Journal of Chemical Information and Modeling|July 25, 2022
HyFactor: A Novel Open-Source, Graph-Based Architecture for Chemical Structure GenerationTagir Akhmetshin, Arkadii Lin, Daniyar Mazitov, et al.Journal of Chemical Information and Modeling|May 8, 2019
CGRtools: Python Library for Molecule, Reaction, and Condensed Graph of Reaction ProcessingRamil I Nugmanov, Ravil N Mukhametgaleev, Tagir Akhmetshin, et al.Journal of Chemical Information and Modeling|December 23, 2025
Design of Highly Potent Antibiofilm, Antimicrobial Peptides Using Explainable Artificial IntelligenceKarina Pikalyova, Tagir Akhmetshin, Alexey Orlov, et al.Molecular Informatics|August 24, 2021
Reaction Data Curation I: Chemical Structures and Transformations StandardizationTimur R Gimadiev, Arkadii Lin, Valentina A Afonina, et al.Pageof 1