GitHub - ankitadu/Chemprop: reproducing chemprop results from publication and local testing with tox20 dataset

Name		Name	Last commit message	Last commit date
Latest commit History 4 Commits
cell_based_assay_traindata_binary_smiles.csv		cell_based_assay_traindata_binary_smiles.csv
pubmed_assay_train.ipynb		pubmed_assay_train.ipynb
pubmed_train		pubmed_train
single_assay_train.csv		single_assay_train.csv