GDB-17 Dataset Card
A dataset card for the Generated Database 17 (GDB-17), a database of 166.4 billion small organic molecules for exploring chemical space and drug …
Smiles-Strings
3 posts tagged with smiles-strings.
GDB-11 Dataset Card
A dataset card for the Generated Database 11 (GDB-11), a database of 26.4 million small organic molecules for virtual screening and drug discovery.
GDB-13 Dataset Card
A dataset card for the Generated Database 13 (GDB-13), a database of nearly 1 billion small organic molecules for virtual screening and drug …