Exhaustive Chemical Enumeration for United Formula Annotation. A pipeline to annotate a number of peaks from the 'IDSL.IPA' peaklists using an exhaustive chemical enumeration-based approach. This package can perform elemental composition calculations using the following 15 elements : C, B, Br, Cl, K, S, Si, N, H, As, F, I, Na, O, and P.
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curl https://depscope.dev/api/check/cran/IDSL.UFAxFirst published · 2023-04-05 20:15:25
Last updated · 2023-04-05T18:03:34+00:00