DFT boosts machine-learning models of nucleophilic aromatic substitution reactions

Retrieved on: 2021-01-06 14:26:15

Tags for this article:

Click the tags to see associated articles and topics

DFT boosts machine-learning models of nucleophilic aromatic substitution reactions. View article details on hiswai:

Excerpt

Researchers in the UK and Sweden have combined density functional theory (DFT) and machine learning to develop a method that accurately ...

Article found on: www.chemistryworld.com