Accelerating Chemical Discovery with Machine Learning: Simulated Evolution of Spin Crossover Complexes with an Artificial Neural Network

Document Details

Document Type
Pub Defense Publication
Publication Date
Feb 15, 2018
Source ID
10.1021/acs.jpclett.8b00170

Entities

People

  • Heather J. Kulik
  • Jon Paul Janet
  • Lydia Chan

Organizations

  • Burroughs Wellcome Fund
  • Division of Chemical, Bioengineering, Environmental, and Transport Systems
  • Massachusetts Institute of Technology
  • Office of Basic Energy Sciences
  • Office of Naval Research Global

Tags

Technology Areas

  • AI & ML
  • AI & ML - Neural Networks