Published August 26, 2024 | Version v1
Dataset Open

Pretraining Graph Transformers with Atom-in-a-Molecule Quantum Properties for Improved ADMET Modeling

Authors/Creators

  • 1. Johnson & Johnson

Files

Files (248.0 MB)

Name Size Download all
md5:3bbfe969eaed756ff53412c9cf05eba6
179.4 MB Download
md5:48af74690633025b12a3773f099078d2
68.6 MB Download

Additional details

Related works

Is derived from
Dataset: 10.6084/m9.figshare.12818702.v1 (DOI)
Dataset: https://ogb.stanford.edu/docs/lsc/pcqm4mv2/ (URL)

Software

Programming language
Python