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a1e3c42
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Parent(s):
826c5fd
Update code/alphafold_featureVector.py
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code/alphafold_featureVector.py
CHANGED
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@@ -32,17 +32,13 @@ def getModelInfo(uniprotID, varPos, wt, models_we_need, path_to_output_files ):
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st.write(uniprotID)
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for mod in models_we_need:
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st.write(f"AF-{uniprotID}-F{mod}-model_v4.pdb.gz")
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try:
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pdb_path = hf_hub_download(repo_id="HuBioDataLab/AlphafoldStructures", filename=f"AF-{uniprotID}-F{mod}-model_v4.pdb.gz",repo_type = 'dataset')
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except u.EntryNotFoundError:
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try:
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pdb_path = hf_hub_download(repo_id="HuBioDataLab/AlphafoldStructures2", filename=f"AF-{uniprotID}-F{mod}-model_v4.pdb.gz",repo_type = 'dataset')
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except u.EntryNotFoundError:
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-
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pdb_path = hf_hub_download(repo_id="HuBioDataLab/AlphafoldStructures3", filename=f"AF-{uniprotID}-F{mod}-model_v4.pdb.gz",repo_type = 'dataset')
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except u.EntryNotFoundError:
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st.write('Requested file not found.')
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sasa_val = freesasa(pdb_path, path_to_output_files, uniprotID, mod, varPos, wt)
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st.write(uniprotID)
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for mod in models_we_need:
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try:
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pdb_path = hf_hub_download(repo_id="HuBioDataLab/AlphafoldStructures", filename=f"AF-{uniprotID}-F{mod}-model_v4.pdb.gz",repo_type = 'dataset')
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except u.EntryNotFoundError:
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try:
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pdb_path = hf_hub_download(repo_id="HuBioDataLab/AlphafoldStructures2", filename=f"AF-{uniprotID}-F{mod}-model_v4.pdb.gz",repo_type = 'dataset')
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except u.EntryNotFoundError:
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pdb_path = hf_hub_download(repo_id="HuBioDataLab/AlphafoldStructures3", filename=f"AF-{uniprotID}-F{mod}-model_v4.pdb.gz",repo_type = 'dataset')
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sasa_val = freesasa(pdb_path, path_to_output_files, uniprotID, mod, varPos, wt)
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