• Preprint 235

Technical Report 235, c4e-Preprint Series, Cambridge

From data base to knowledge graph - using data in chemistry

Reference: Technical Report 235, c4e-Preprint Series, Cambridge, 2019

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Highlights
  • A review on web based data bases used to store chemical information.
  • Discussion on the role of knowledge graphs in chemical model development.
Abstract

Graphical abstract Over the last couple of decades, the scientific community has made large efforts to process and store experimental and computational chemical data and information on the world wide web. This review summarizes several databases and ontologies available on the web for researchers to use. We also discuss briefly the categories of chemistry data that are stored, its main usage and how it can be accessed and understood in the framework of the Semantic Web.

Material from this preprint has been published in Current Opinion in Chemical Engineering.

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