Yan Ivanenkov

According to our database, Yan Ivanenkov authored at least 5 papers between 2018 and 2025.

Collaborative distances:

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

2025

Enhancing accuracy of virtual kinase profiling via application of graph neural network to 3D pharmacophore ensembles.

Alexey V. Ereshchenko, Sergei A. Evteev, Alexander Malyshev, Denis Adjugim, Fedor Sizov, Anna Pastukhova, Victor Terentiev, Petr Shegai, Andrey Kaprin, Yan Ivanenkov

J. Comput. Aided Mol. Des., December, 2025

2023

Chemistry42: An AI-Driven Platform for Molecular Design and Optimization.

Yan A. Ivanenkov, Daniil Polykovskiy, Dmitry Bezrukov, Bogdan Zagribelnyy, Vladimir Aladinskiy, Petrina Kamya, Alex Aliper, Feng Ren, Alex Zhavoronkov

J. Chem. Inf. Model., February, 2023

SiteRadar: Utilizing Graph Machine Learning for Precise Mapping of Protein-Ligand-Binding Sites.

Sergei A. Evteev, Alexey V. Ereshchenko, Yan A. Ivanenkov

J. Chem. Inf. Model., February, 2023

2021

Chemistry42: An AI-based platform for de novo molecular design.

Yan A. Ivanenkov, Alexander Zhebrak, Dmitry Bezrukov, Bogdan Zagribelnyy, Vladimir Aladinskiy, Daniil Polykovskiy, Evgeny Putin, Petrina Kamya, Alexander Aliper, Alex Zhavoronkov

CoRR, 2021

2018

Reinforced Adversarial Neural Computer for de Novo Molecular Design.

Evgeny Putin, Arip Asadulaev, Yan Ivanenkov, Vladimir Aladinskiy, Benjamín Sánchez-Lengeling, Alán Aspuru-Guzik, Alex Zhavoronkov

J. Chem. Inf. Model., 2018