AI-Guided Discovery of Novel Ionic Liquid Solvents for Industrial CO2 Capture. - Davide Garbelotto; Alexander Lobo; Urvi Awasthi; Oleg N. Medvedev; Srayanta Mukherjee; Anton Aristov; Konstantin Polunin; Alex De Mur; Leonid Zhukov; Azad Huseynov; Murad Abdullayev (CoRR, 2026)

Property-Guided Molecular Generation and Optimization via Latent Flows. - Alexander Lobo; Urvi Awasthi; Leonid Zhukov (CoRR, 2026)

Hierarchy-Guided Topology Latent Flow for Molecular Graph Generation. - Urvi Awasthi; Alexander Lobo; Leonid Zhukov (CoRR, 2026)