RGFN: Synthesizable Molecular Generation Using GFlowNets. - Michal Koziarski; Andrei Rekesh; Dmytro Shevchuk; Almer van der Sloot; Piotr Gainski; Yoshua Bengio; Cheng-Hao Liu; Mike Tyers; Robert A. Batey (NeurIPS, 2024)

Scalable and Cost-Efficient de Novo Template-Based Molecular Generation. - Piotr Gainski; Oussama Boussif; Andrei Rekesh; Dmytro Shevchuk; Ali Parviz; Mike Tyers; Robert A. Batey; Michal Koziarski (CoRR, 2025)

SynCoGen: Synthesizable 3D Molecule Generation via Joint Reaction and Coordinate Modeling. - Andrei Rekesh; Miruna T. Cretu; Dmytro Shevchuk; Vignesh Ram Somnath; Pietro Liò; Robert A. Batey; Mike Tyers; Michal Koziarski; Cheng-Hao Liu (CoRR, 2025)