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gwallison avatar gwallison commented on August 23, 2024

Added field chemInfo_available into the data set that indicates if a bgCAS has ChemIformatics data available. A table with all the scores and authorities for those bgCAS is now in the repo's curation_files directory. In addition, the ChemInfo_ref_files dir in the final repo has the three results files from the CI request performed during the build. Those files are

  • Hazard xlsx version - has the colored table as well as much of the data that was used to score the chemical
  • Hazard sdf version - a text file that is used to create the simple score/authority table for the 20 characteristics
  • Safety xlsx version - has a lot of summary information for each chemical and links to specific safety documentation.

from openff.

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