Most Relevant Talks

A link to the most relevant talks related to IBM RXN for Chemistry

Learning how to do chemical reactions from data

Presentation by Alain Vaucher at the Swiss Chemical Society Meeting, August 25th 2020. PDF available here: learn_reactions_public.

Chemistry Puppeteer

Presentation by Alessandra Toniato at ACS Fall Meeting 2020, talking about increasing the diversity of retro-synthetic predictions. Slides: alessandra-ACS2020

Unsupervised Attention-Guided Atom-Mapping

Slides of the talk by P. Schwaller at the Cambridge MLDG seminar: cambridge_MLDG_atom_mapping .