--- title: Chemprop Example emoji: 🚀 colorFrom: blue colorTo: red sdk: docker pinned: false license: mit --- Check out the configuration reference at https://huggingface.co/docs/hub/spaces-config-reference --- Chemprop and infos about it can be found at https://github.com/chemprop/chemprop --- Training data from: https://github.com/hesther/reactiondatabase --- save results in dataset, see https://huggingface.co/docs/huggingface_hub/main/en/guides/upload#scheduled-uploads --- chemprop example scripts: https://github.com/chemprop/chemprop_benchmark/tree/main (for v1 though)