De Novo Molecular Design by Combining Deep Autoencoder Recurrent Neural Networks with Generative Topographic Mapping. - Boris Sattarov; Igor I. Baskin; Dragos Horvath; Gilles Marcou; Esben Jannik Bjerrum; Alexandre Varnek (J. Chem. Inf. Model., 2019)

Learning to Navigate The Synthetically Accessible Chemical Space Using Reinforcement Learning. - Sai Krishna Gottipati; Boris Sattarov; Sufeng Niu; Yashaswi Pathak; Haoran Wei; Shengchao Liu; Simon Blackburn; Karam M. J. Thomas; Connor W. Coley; Jian Tang 005; Sarath Chandar; Yoshua Bengio (ICML, 2020)

Towered Actor Critic For Handling Multiple Action Types In Reinforcement Learning For Drug Discovery. - Sai Krishna Gottipati; Yashaswi Pathak; Boris Sattarov; Sahir; Rohan Nuttall; Mohammad Amini; Matthew E. Taylor; Sarath Chandar (AAAI, 2021)