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Description
Please view the Contributing Guidelines for information on Contributing.
Is your feature request related to a problem? Please describe.
The current comparison algorithm is kind of a database search algorithm that looks through the database and selects all the lines which lie in the error region. It does not take into account the shift in the spectrum which might cause a lot of false positive peaks.
This also causes lots of detected peaks to match with multiple elements. Obviously the current search is important as it gives us lots of good results, but we need a way to refine the results.
Describe the solution you'd like
- Add a function which takes in the dictionary output of the element_list_comparison() function and refines the results and removes false positives. This can be done either using a statistical analysis of the result or it can be done using a standard reference of trusted peaks or combination of peaks.
Describe alternatives you've considered
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Additional context
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