LCSB Environmental Cheminformatics Group

There is a newer version of the record available.

Published May 1, 2018 | Version CompTox_01May18
Dataset Open

MetFrag Local CSV: CompTox (1 May 2018 release) MetaData Files

Authors/Creators

  • 1. LCSB, Uni Luxembourg

Description

These are the CSV files that can be used as a local database in MetFrag (https://msbi.ipb-halle.de/MetFrag/), for those who wish to integrate this into the command line version.

Note that this file is TOO LARGE to be uploaded via the web interface, updated versions of these files are integrated in the web interface.

This upload includes the SelectMetaData, SelectMetaDataPlus and AllMetaData versions of the CompTox MetFrag file from the 1 May 2018 release (DOI:10.23645/epacomptox.7525199.v1).

Files

CompTox_01May18_AllMetaData.csv

Files (846.7 MB)

Name Size
md5:860e4e67c8d2c8307045ba5ef89d461b
320.9 MB Preview Download
md5:81e0557b63bae96a902c02551daa8804
260.0 MB Preview Download
md5:4d342f22a572105348cd98d0b4c2dc60
265.9 MB Preview Download

Additional details

Related works

Is supplement to
https://msbi.ipb-halle.de/MetFrag/ (URL)
https://comptox.epa.gov/dashboard/ (URL)
10.23645/epacomptox.7525199.v1 (DOI)