Similarity based enzymatic retrosynthesis
Abstract
Using a large database of enzymatic transformations, similarity based enzymatic retrosynthesis search algorithm takes a holistic approach to enzymatic synthesis planning to yield a diverse set of single-step suggestions.
Document Details
- Document Type
- Pub Defense Publication
- Publication Date
- Jan 01, 2022
- Source ID
- 10.1039/d2sc01588a
Entities
People
- Connor W. Coley
- Deeptak Verma
- Esther Heid
- Karthik Sankaranarayanan
- Klavs F. Jensen
- William H. Green
Organizations
- Austrian Science Fund
- Defense Advanced Research Projects Agency
- Massachusetts Institute of Technology
- Merck & Co.
- TU Wien