COSMIC: Molecular Conformation Space Modeling in Internal Coordinates with an Adversarial Framework. - Maksim Kuznetsov; Fedor Ryabov; Roman Schutski; Rim Shayakhmetov; Yen-Chu Lin; Alex Aliper; Daniil Polykovskiy (J. Chem. Inf. Model., 2024)

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 (AAAI, 2025)

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 (AAAI, 2025)