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Move changes from structure update to dev-2 #119

Merged
merged 220 commits into from
Apr 12, 2024
Merged

Move changes from structure update to dev-2 #119

merged 220 commits into from
Apr 12, 2024

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GwennyGit
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The structure update is done so far. Moving the changes to dev-2 to move forward to a new release.

GwennyGit and others added 30 commits August 21, 2023 12:01
- restructured media documentation
- added new description for database
extended load_model_cobra to allow entering all types of model files readable by cobrapy
update reannotate SBO
analysis_biocyc.py:
1. chemical formula error catching
2. check if input paths exists because PICNIC

analysis_db:
1. added multiprocessing for BiGG db requests, currently splitted in 5 threads, more might overwhelm db?

1. TODO: progress bar is not working
2. TODO: SettingWithCopyWarning: A value is trying to be set on a copy of a slice from a DataFrame.
Try using .loc[row_index,col_indexer] = value instead
in line 165, 170 -> however .loc is used, I dont see the issue here...

gapfill.py:
1. avoid conflicts while converting None ChEBI values to floats
fixed the progress bar & accidentally enhanced the run time of gap_analysis

added to analysis db:
pd.options.mode.chained_assignment = None # suppresses the pandas SettingWithCopyWarning; comment out before developing!!
- Added logo to Zenodo DOI & changed appearance of badge
- Added DOI for publication in Frontiers
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