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u = mda.Universe(topology_file, trajectory_file)
average = align.AverageStructure(u, u, select=mda_rmsf_avg_struc_sel,
ref_frame=0).run()
ref = average.results.universe
aligner = align.AlignTraj(u, ref,
select=mda_rmsf_avg_struc_sel,
filename=trajectory_file,
in_memory=False).run()
when I hit this error:
Exception has occurred: RuntimeError
generator raised StopIteration
StopIteration:
The above exception was the direct cause of the following exception:
File "/home/hoalt/code/master-pipeline/src/packages/md/md/analysis.py", line 230, in log_RMSF
in_memory=False).run()
File "/home/hoalt/code/master-pipeline/src/packages/md/md/analysis.py", line 722, in analyze_trajectory
log_RMSF(trajectory_file=trajectory_file,
File "/home/hoalt/code/master-pipeline/src/packages/md/md/analysis.py", line 844, in main
analyze_trajectory(md_outdir=args.md_outdir,
File "/home/hoalt/tool/miniforge3/envs/masterpipeline/bin/md_analyze", line 6, in <module>
sys.exit(main())
RuntimeError: generator raised StopIteration
No idea what this was about. Any help is appreciated!
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Hello,
I was running this code:
when I hit this error:
No idea what this was about. Any help is appreciated!
Best regards,
Hoa
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