molssiai-hub/pubchemqc-pm6 download history

molssiai-hub/pubchemqc-pm6 is a tabular regression dataset on the Hugging Face Hub. In the last 30 days it was downloaded 26,092 times (3,362 in the last 7 days), and 69,095 times in total. It ranks #1,168 among datasets by monthly downloads.

The PubChemQC PM6 dataset consists of optimized molecular geometries and electronic properties calculated by the PM6 method for 94.0% of the 91.6 million molecules cataloged in PubChem Compounds retrieved on August 29, 2016. In addition to neutral states, the cationic, anionic, and spin flipped elec

Spaces using pubchemqc-pm6

• Model Pulse 8 likes

Open molssiai-hub/pubchemqc-pm6 on Hugging Face

Sister project: Paper Pulse, the upvote history of every Hugging Face Daily Paper.