Oleksandr Gurbych

According to our database, Oleksandr Gurbych authored at least 5 papers between 2020 and 2023.

Collaborative distances:

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

2023

Advancing molecular graphs with descriptors for the prediction of chemical reaction yields.

Dzvenymyra Yarish, Sofiya Garkot, Oleksandr O. Grygorenko, Dmytro S. Radchenko, Yurii S. Moroz, Oleksandr Gurbych

J. Comput. Chem., January, 2023

2022

Complex machine learning model needs complex testing: Examining predictability of molecular binding affinity by a graph neural network.

Tymofii Yu. Nikolaienko, Oleksandr Gurbych, Maksym Druchok

J. Comput. Chem., 2022

2021

Toward efficient generation, correction, and properties control of unique drug-like structures.

Maksym Druchok, Dzvenymyra Yarish, Oleksandr Gurbych, Mykola Maksymenko

J. Comput. Chem., 2021

Ensembling machine learning models to boost molecular affinity prediction.

Maksym Druchok, Dzvenymyra Yarish, Sofiya Garkot, Tymofii Yu. Nikolaienko, Oleksandr Gurbych

Comput. Biol. Chem., 2021

2020

High throughput screening with machine learning.

Oleksandr Gurbych, Maksym Druchok, Dzvenymyra Yarish, Sofiya Garkot

CoRR, 2020