cheminfo / cheminfo/mass-tools

Report EICs characteristics

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Dominant language
JavaScript
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9
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0
Avg merge
1d 22h
Merged PRs (30d)
3

Description

Users may visualize extracted ion chromatograms.
It would be useful to have the characteristics of the EIC automatically reported in a table: retention time at peak maximum, FWHM, area.
This is especially useful for analysis where a chromatogram peak picking is not possible (ex: SEC or IMS data).
(A determination of FWHM from a gaussian fit would be even better.)

Contributor guide

No contributing guide indexed for this repository

Research direction

The issue does not name a file, test, or entry point. Start by tracing how extracted ion chromatograms are generated and displayed, then identify where a table of retention time at peak maximum, FWHM, and area belongs. Done means these characteristics are reported for EICs; Gaussian-fit FWHM is described as an optional improvement.

Written by the indexing model from the issue text.

Assessment

Tech stack
javascript
Domain
data-visualization
Issue type
Feature
Difficulty
4/5
Estimated time
3-5 days
Activity status
Stale
Clarity
Mostly clear
Newbie friendliness
35/100

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