| 2025 | AAAI | nach0-pc: Multi-task Language Model with Molecular Point Cloud Encoder. | Maksim Kuznetsov, Airat Valiev, Alex Aliper, Daniil Polykovskiy, Elena Tutubalina, Rim Shayakhmetov, Zulfat Miftahutdinov |
| 2025 | AAAI | BindGPT: A Scalable Framework for 3D Molecular Design via Language Modeling and Reinforcement Learning. | Artem Zholus, Maksim Kuznetsov, Roman Schutski, Rim Shayakhmetov, Daniil Polykovskiy, Sarath Chandar, Alex Zhavoronkov |
| 2021 | AAAI | MolGrow: A Graph Normalizing Flow for Hierarchical Molecular Generation. | Maksim Kuznetsov, Daniil Polykovskiy |
| 2020 | AISTATS | Deterministic Decoding for Discrete Data in Variational Autoencoders. | Daniil Polykovskiy, Dmitry P. Vetrov |
| 2018 | ACML | ReSet: Learning Recurrent Dynamic Routing in ResNet-like Neural Networks. | Iurii Kemaev, Daniil Polykovskiy, Dmitry P. Vetrov |
| 2018 | ACML | Extracting Invariant Features From Images Using An Equivariant Autoencoder. | Denis Kuzminykh, Daniil Polykovskiy, Alexander Zhebrak |
| 2018 | ACML | Concorde: Morphological Agreement in Conversational Models. | Daniil Polykovskiy, Dmitry Soloviev, Sergey I. Nikolenko |