BERT Learns (and Teaches) Chemistry

11 Jul 2020Josh PayneMario SroujiDian Ang YapVineet Kosaraju

Modern computational organic chemistry is becoming increasingly data-driven. There remain a large number of important unsolved problems in this area such as product prediction given reactants, drug discovery, and metric-optimized molecule synthesis, but efforts to solve these problems using machine learning have also increased in recent years... (read more)

PDF Abstract

Code


No code implementations yet. Submit your code now

Results from the Paper


  Submit results from this paper to get state-of-the-art GitHub badges and help the community compare results to other papers.

Methods used in the Paper