AI4Green: An Open-Source ELN for Green and Sustainable Chemistry.

ABSTRACT: An Electronic Laboratory Notebook (ELN) combining features, including data archival, collaboration tools, and green and sustainability metrics for organic chemistry, is presented. AI4Green is a web-based application, available as open-source code and free to use. It offers the core functionality of an ELN, namely, the ability to store reactions securely and share them among different members of a research team. As users plan their reactions and record them in the ELN, green and sustainable chemistry is encouraged by automatically calculating green metrics and color-coding hazards, solvents, and reaction conditions. The interface links a database constructed from data extracted from PubChem, enabling the automatic collation of information for reactions. The application's design facilitates

SUBMITTER: Boobier S 

PROVIDER: S-EPMC10207257 | biostudies-literature | 2023 May

REPOSITORIES: biostudies-literature