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Expand file tree Collapse file tree Original file line number Diff line number Diff line change 44 previous algorithm by Andy Lim https://github.com/bmx8177/MS1Connect
55 published in https://doi.org/10.1093/bioinformatics/btad058.
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7- We improved the original algorithm by using FeatureFinderMultiplexAlgorithm instead of FeatureFinder as originally
8- implemented by Andy Lim. Also, we annotated additional features such as min and max retention time and mz values.
9-
10- This algorithm is used to detect MS1 features from mzML files and save them to parquet format.
7+ We improved the original algorithm with the following ideas:
8+ - Using FeatureFinderMultiplexAlgorithm instead of FeatureFinder as originally implemented by Andy Lim. This will provide
9+ a more robust way to perform FeatureFinding.
10+ - Remove the filtering of percentile TIC for features, we leave this step to future consuming tools of the data to perform
11+ extra curation of the features based on percentile_tic, or quality of the feature, etc.
12+ - We annotated additional features such as min and max retention time and mz values.
13+ - This algorithm is used to detect MS1 features from mzML files and save them to parquet format.
1114"""
1215
1316import bisect
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