Parent: [cf8b65]
added | .gitignore |
added | LICENSE |
added | README.md |
added | datasets/CHEMBL25_TEST_MOLS.h5 |
added | datasets/CHEMBL25_TRAIN_MOLS.h5 |
added | datasets/DRD2_TEST_MOLS.h5 |
added | datasets/DRD2_TRAIN_MOLS.h5 |
added | datasets/DRD2_VALID_MOLS.h5 |
added | datasets/README.md |
added | ddc_pub/__init__.py |
added | ddc_pub/custom_callbacks.py |
added | ddc_pub/ddc_v3.py |
added | ddc_pub/ddc_v3_unbiased.py |
added | ddc_pub/generators.py |
added | ddc_pub/vectorizers.py |
added | demo_cRNN.ipynb |
added | demo_heteroencoder.ipynb |
added | figures/model.png |
added | models/README.md |
added | models/fpb_model.zip |
added | models/heteroencoder_model.zip |
added | models/pcb_model.zip |
added | models/prior_model.zip |
added | models/qsar_model.pickle |
added | models/tl_model.zip |