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Running
on
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Running
on
T4
simonduerr
commited on
Commit
•
f00454f
1
Parent(s):
3055c36
Update app.py
Browse files
app.py
CHANGED
@@ -321,7 +321,7 @@ def preprocess_mol(pdb_code="", filepath=""):
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os.system(f"wget -qnc https://files.rcsb.org/view/{pdb_code}.pdb")
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print(os.getcwd())
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print(os.listdir())
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-
print(os.system(f"
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mol = Molecule(f"{pdb_code}.pdb")
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tf_original = tempfile.NamedTemporaryFile(delete=False)
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mol.write(tf_original.name)
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os.system(f"wget -qnc https://files.rcsb.org/view/{pdb_code}.pdb")
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print(os.getcwd())
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print(os.listdir())
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+
print(os.system(f"head -n20 {pdb_code}.pdb"))
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mol = Molecule(f"{pdb_code}.pdb")
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tf_original = tempfile.NamedTemporaryFile(delete=False)
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mol.write(tf_original.name)
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