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input_config.json
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36 lines (36 loc) · 1.21 KB
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{
"dti_dir": "./SampleData/DTI/Training/Training_DTI_Sample.csv",
"drug_dir": "./SampleData/DTI/Training/Training_Compound_Sample.csv",
"protein_dir": "./SampleData/DTI/Training/Training_Protein_Sample.csv",
"hots_dir": "./SampleData/HoTS/Training_HoTS.tsv",
"validation_dti_dir": "./SampleData/DTI/Validation/Validation_DTI.csv",
"validation_drug_dir": "./SampleData/DTI/Validation/Validation_Compound.csv",
"validation_protein_dir": "./SampleData/DTI/Validation/Validation_Protein.csv",
"validation_hots_dir": "./SampleData/HoTS/Validation_HoTS.tsv",
"window_sizes": [10, 15, 20, 25, 30],
"n_filters": 64,
"drug_layers": [512, 128],
"hots_dimension": 128,
"n_heads": 4,
"n_transformers_hots": 2,
"n_transformers_dti": 4,
"hots_fc_layers": [256, 64],
"dti_fc_layers": [256, 64],
"anchors": [9],
"grid_size": 20,
"learning_rate": 0.0001,
"n_pretrain": 1,
"n_epochs": 1,
"hots_ratio": 1,
"retina_loss": 2.0,
"confidence_loss": 1,
"regression_loss": 0.1,
"negative_loss": 0.1,
"drug_len": 2048,
"radius": 2,
"activation": "gelu",
"dropout": 0.1,
"batch_size": 16,
"decay": 0.0001,
"output": "./Saved_model"
}