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README.md

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@@ -264,13 +264,13 @@ Now that we know Docker is functioning properly, we can begin building our Docke
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6. Run `run_docker.py` pointing to two input PDB files containing the first and second chains
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of a complex for which you wish to predict the contact probability map.
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For example, for the DIPS-Plus test target with the PDB ID: 4HEQ:
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For example, for the DIPS-Plus test target with the PDB ID `4HEQ`:
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```bash
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python3 docker/run_docker.py --left_pdb_filepath "$DI_DIR"/project/test_data/4heq_l_u.pdb --right_pdb_filepath "$DI_DIR"/project/test_data/4heq_r_u.pdb --input_dataset_dir "$DI_DIR"/project/datasets/Input --ckpt_name "$DI_DIR"/project/checkpoints/LitGINI-GeoTran-DilResNet.ckpt --hhsuite_db ~/Data/Databases/bfd/bfd_metaclust_clu_complete_id30_c90_final_seq.sorted_opt --num_gpus 0
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```
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This script will generate and (as NumPy array files - e.g., test_data/4heq_contact_prob_map.npy)
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This script will generate and (as NumPy array files - e.g., `test_data/4heq_contact_prob_map.npy`)
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save to the given input directory the predicted interface contact map as well as the Geometric
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Transformer's learned node and edge representations for both chain graphs.
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@@ -452,7 +452,7 @@ python3 lit_model_predict.py --left_pdb_filepath "$DI_DIR"/project/test_data/4he
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cd ..
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```
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This script will generate and (as NumPy array files - e.g., test_data/4heq_contact_prob_map.npy)
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This script will generate and (as NumPy array files - e.g., `test_data/4heq_contact_prob_map.npy`)
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save to the given input directory the predicted interface contact map as well as the
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Geometric Transformer's learned node and edge representations for both chain graphs.
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