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schwede
af2-at-scicore
Commits
671efc23
Commit
671efc23
authored
3 years ago
by
Bienchen
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Fixed path to new PDB obsolete.dat
parent
7fb5bd3b
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run_af2/src/run_af2/run_singularity.py
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run_af2/src/run_af2/run_singularity.py
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run_af2/src/run_af2/run_singularity.py
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671efc23
...
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@@ -219,7 +219,9 @@ def run_af2_singularity_image( # pylint: disable=too-many-arguments
# template_mmcif_dir="/scicore/data/managed/PDB/latest/data/structures/all/"
# + "mmcif_files/",
template_mmcif_dir
=
"
/scicore/home/schwede/GROUP/alphafold_data/pdb_mmcif
"
,
obsolete_pdbs_path
=
"
/scicore/data/managed/PDB/latest/data/status/
"
# obsolete_pdbs_path="/scicore/data/managed/PDB/latest/data/status/"
# + "obsolete.dat",
obsolete_pdbs_path
=
"
/scicore/home/schwede/GROUP/alphafold_data/pdb_mmcif/
"
+
"
obsolete.dat
"
,
):
"""
Run the AlphaFold 2 Singularity image on host.
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