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fc0ba60
1
Parent(s):
ae8cb90
Update code/pdb_featureVector.py
Browse files
code/pdb_featureVector.py
CHANGED
@@ -230,19 +230,23 @@ def pdb(input_set, mode, impute):
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for search in pdbs:
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# Step 1: Fetch the PDB file
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pdb_url = f"https://files.rcsb.org/download/{search}.pdb"
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try:
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response = requests.get(pdb_url)
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response.raise_for_status() # Check for a successful response
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except :
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continue # Skip to the next PDB code if fetching fails
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-
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# Step 2: Parse the PDB file from memory
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pdb_data = response.text
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pdb_parser = PDBParser(QUIET=True) # QUIET=True suppresses warnings
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pdb_file_content = StringIO(pdb_data)
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structure = pdb_parser.get_structure(pdb_code, pdb_file_content)
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ppb = PPBuilder()
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for model in structure:
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for pp in ppb.build_peptides(model):
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sequence = pp.get_sequence()
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for chain in model:
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for search in pdbs:
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# Step 1: Fetch the PDB file
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pdb_url = f"https://files.rcsb.org/download/{search}.pdb"
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st.write(pdb_url)
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try:
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response = requests.get(pdb_url)
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st.write('response', response)
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response.raise_for_status() # Check for a successful response
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except :
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continue # Skip to the next PDB code if fetching fails
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st.write('response2', response)
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# Step 2: Parse the PDB file from memory
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pdb_data = response.text
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st.write('pdb_data', pdb_data)
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pdb_parser = PDBParser(QUIET=True) # QUIET=True suppresses warnings
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pdb_file_content = StringIO(pdb_data)
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structure = pdb_parser.get_structure(pdb_code, pdb_file_content)
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ppb = PPBuilder()
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for model in structure:
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st.write(model)
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for pp in ppb.build_peptides(model):
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sequence = pp.get_sequence()
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for chain in model:
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