Featured
-
-
Perspective |
Making the collective knowledge of chemistry open and machine actionable
A substantial proportion of the data generated in chemistry research is captured non-digitally and reported in ways that non-accessible to both humans and computers. A variety of tools do exist to capture, analyse and publish data in an open, reusable, machine-actionable manner — they should be connected to create an open-science platform for chemistry.
- Kevin Maik Jablonka
- , Luc Patiny
- & Berend Smit
-
Comment |
Best practices in machine learning for chemistry
Statistical tools based on machine learning are becoming integrated into chemistry research workflows. We discuss the elements necessary to train reliable, repeatable and reproducible models, and recommend a set of guidelines for machine learning reports.
- Nongnuch Artrith
- , Keith T. Butler
- & Aron Walsh
-
-
Article |
Precision design of ethylene- and polar-monomer-based copolymers by organometallic-mediated radical polymerization
Copolymers of ethylene and polar monomers are produced industrially using free radical polymerization that leads to broad molecular weight distributions of products with ill-defined structures. Now, an organo–cobalt complex is shown to control the radical copolymerization of ethylene with polar monomers under mild experimental conditions, and allows access to block-like copolymers with targeted compositions and monomer distributions.
- Anthony Kermagoret
- , Antoine Debuigne
- & Christophe Detrembleur
-