Published March 5, 2023 | Version 1.0
Dataset Open

Global-Chem Raw Data Volume 1

Authors/Creators

  • 1. University of Maryland, School of Pharmacy

Description

Global-Chem Raw Data Official Release Volume 1. 

Table data headlines are:

  • Chemical Name - Common Chemical Name Recorded in The Dictionary
  • Molecule: SMILES representation of the molecule
  • Node: Node that the molecule belongs too.
  • Node Path: Node Path of the Graph Network

Files

Files (521.4 kB)

Name Size Download all
md5:d5bc988324b31e5d9766d89690490a2e
521.4 kB Download

Additional details

Related works

Is supplemented by
10.5281/zenodo.7337935 (DOI)