Thermal Half-Lives of Azobenzene Derivatives: Virtual Screening Based on Intersystem Crossing Using a Machine Learning Potential
Document Details
- Document Type
- Pub Defense Publication
- Publication Date
- Jan 25, 2023
- Source ID
- 10.1021/acscentsci.2c00897
Entities
People
- Eugene I. Shakhnovich
- Rafael Gómez-Bombarelli
- Simon Axelrod
Organizations
- Defense Advanced Research Projects Agency
- Harvard University
- Massachusetts Institute of Technology