ChemCat – Append and Visualize Chemical Metadata

Link compounds in your dataset using unique identifiers to built-in or user uploaded libraries containing chemical metadata, for example linking use and source information, predicted toxicities, and chemical fate and transport. This user-friendly software can also be used to perform data-processing for gas chromatography and other mass spectrometry datasets (GC-MS and LC-MS for example) including blank filtering, total EI deconvoluted signal estimation from peak heights and average TICs, and duplicate removal. Visualizations include pie charts, bar charts, and donut plots of major and minor category distribution for the entire dataset. Source, use, and other information can also be visualized across sample groups.