SciData - Example Data Files

Below are a list of the context files developed for the scientific data model, with examples. Readers wanting to see how the JSON-LD files convert to RDF should go to the JSON-LD Playground. NOTE: JSON can be best viewed using Firefox and the JSONView extension.

SciData Translations of Data from Common Websites

• Crystallographic Information Framework (CIF) File - Original File · XSLT Converter
• Dortmund Data Bank (DDB) Data Page - Original Page (HTML needed cleanup) · XSLT Converter
• PubChem PUGREST Download (XML) - Original File · XSLT Converter · Convert to RDF

SciData Example Data Documents

• pH Measurement - see this files RDF triples
• Refractive Index Value from the Literature - see this files RDF triples
• SCF Calculation - see this files RDF triples
• NMR Spectrum - see this files RDF triples
• Solubility Data - see this files RDF triples

Examples of Methodology, System, Dataset, Parameter, Value and Unit Sections

• computational methodology aspects OR experimental methodology aspects
• computational system facets OR experimental system facets
• data (includes datagroup,dataseries, datapoint
• generic parameter or array of parameter values
• a value (numeric or text) or array of values
• representation or referencing scientific units

Examples of Methodology Aspects

For Experimental Data

• measurement metadata
• procedural metadata
• laboratory resource

For Computational Data

• basis set metadata
• calculation metadata
• computational software metadata

Examples of System Facets

For Experimental Data

• chemical metadata
• mixture metadata
• substance metadata

For Computational Data

• computer processing metadata
• molecular system metadata

Stuart Chalk
Department of Chemistry
University of North Florida
Phone: 1-904-620-1938
Email: schalk@unf.edu
ORCID: 0000-0002-0703-7776