├── CC-BY-NC-SA-4.0 ├── DeepConvDTI.py ├── LICENSE ├── README.md ├── evaluate_performance.py ├── predict_with_model.py └── toy_examples ├── test_dataset ├── test_compound.csv ├── test_dti.csv └── test_protein.csv ├── training_dataset ├── training_compound.csv ├── training_dti.csv └── training_protein.csv └── validation_dataset ├── validation_compound.csv ├── validation_dti.csv └── validation_protein.csv /CC-BY-NC-SA-4.0: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/CC-BY-NC-SA-4.0 -------------------------------------------------------------------------------- /DeepConvDTI.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/DeepConvDTI.py -------------------------------------------------------------------------------- /LICENSE: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/LICENSE -------------------------------------------------------------------------------- /README.md: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/README.md -------------------------------------------------------------------------------- /evaluate_performance.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/evaluate_performance.py -------------------------------------------------------------------------------- /predict_with_model.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/predict_with_model.py -------------------------------------------------------------------------------- /toy_examples/test_dataset/test_compound.csv: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/toy_examples/test_dataset/test_compound.csv -------------------------------------------------------------------------------- /toy_examples/test_dataset/test_dti.csv: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/toy_examples/test_dataset/test_dti.csv -------------------------------------------------------------------------------- /toy_examples/test_dataset/test_protein.csv: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/toy_examples/test_dataset/test_protein.csv -------------------------------------------------------------------------------- /toy_examples/training_dataset/training_compound.csv: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/toy_examples/training_dataset/training_compound.csv -------------------------------------------------------------------------------- /toy_examples/training_dataset/training_dti.csv: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/toy_examples/training_dataset/training_dti.csv -------------------------------------------------------------------------------- /toy_examples/training_dataset/training_protein.csv: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/toy_examples/training_dataset/training_protein.csv -------------------------------------------------------------------------------- /toy_examples/validation_dataset/validation_compound.csv: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/toy_examples/validation_dataset/validation_compound.csv -------------------------------------------------------------------------------- /toy_examples/validation_dataset/validation_dti.csv: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/toy_examples/validation_dataset/validation_dti.csv -------------------------------------------------------------------------------- /toy_examples/validation_dataset/validation_protein.csv: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/GIST-CSBL/DeepConv-DTI/HEAD/toy_examples/validation_dataset/validation_protein.csv --------------------------------------------------------------------------------