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test branch under bkieft account
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bkieft-usa committed Nov 4, 2024
1 parent 1aa91ac commit 4fc73f1
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Showing 2 changed files with 4 additions and 6 deletions.
8 changes: 3 additions & 5 deletions metatlas/untargeted/run_untargeted_pipeline.py
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Expand Up @@ -2,7 +2,7 @@
import sys
import argparse
import logging
sys.path.insert(0,'/global/common/software/m2650/metatlas-repo/')
sys.path.insert(0,'/global/homes/b/bkieft/metatlas/')
from metatlas.untargeted import tools as mzm

##### Parse command line arguments
Expand Down Expand Up @@ -56,7 +56,7 @@ def main():
##### Checking for completed FBMN jobs and downloading results
mzm.download_untargeted_results_from_gnps2(output_dir=args.output_dir, direct_input=args.direct_input, skip_merge_gnps2_results=args.skip_merge_gnps2_results, \
overwrite_mzmine=args.overwrite_mzmine, overwrite_fbmn=args.overwrite_fbmn, overwrite_buddy=args.overwrite_buddy, \
skip_fbmn_download=step_bools['fbmn_download'], skip_buddy_download=step_bools['buddy_download'], skip_mzmine_download=step_bools['mzmine_download'], \
skip_results_download=step_bools['results_download'], \
background_designator=args.background_designator, background_ratio=args.background_ratio, \
zero_value=args.zero_value,nonpolar_solvent_front=args.nonpolar_solvent_front, \
polar_solvent_front=args.polar_solvent_front)
Expand Down Expand Up @@ -146,9 +146,7 @@ def check_skipped_steps(args):
"fbmn_status": False,
"fbmn_submit": False,
"buddy_submit": False,
"mzmine_download": False,
"fbmn_download": False,
"buddy_download": False,
"results_download": False,
"zip_upload": False
}
if args.skip_steps is not None:
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2 changes: 1 addition & 1 deletion metatlas/untargeted/tools.py
Original file line number Diff line number Diff line change
Expand Up @@ -11,7 +11,7 @@
import time
import subprocess
import math
sys.path.insert(0,'/global/common/software/m2650/metatlas-repo/')
sys.path.insert(0,'/global/homes/b/bkieft/metatlas/')
import metatlas.tools.validate_filenames as vfn
import subprocess
import grp
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