Validation of computer algorithms with University of Münster

A project between the Reaxys team and Mark Waller's team at the University of Muenster

Status	Finished
Effective start/end date	01/1/16 → 01/1/18

Modelling Chemical Reasoning to Predict and Invent Reactions
Segler, M. & Waller, M., Feb 1 2017, In: Wiley Online Library.
Research output: Contribution to journal › Article › peer-review
80 Scopus citations
Neural‐Symbolic Machine Learning for Retrosynthesis and Reaction Prediction
Segler, M. & Waller, M., Jan 1 2017, In: Chemistry - A European Journal. 23, 25, p. 5966-5971 6 p.
Research output: Contribution to journal › Article › peer-review
152 Scopus citations
Planning chemical syntheses with deep neural networks and symbolic AI
Segler, M., Segler, M., Preuss, M. & Waller, M., Jan 1 2017, In: Nature. International journal of science.
Research output: Contribution to journal › Article › peer-review

Project Details