State-of-the-art augmented NLP transformer models for direct and single-step retrosynthesis

by Igor V. Tetko, Pavel Karpov, Ruud Van Deursen, Guillaume Godin
Published 2020-11-01

GEN: highly efficient SMILES explorer using autodidactic generative examination networks

by Ruud van Deursen, Peter Ertl, Igor V. Tetko, Guillaume Godin
Published 2020-04-01