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elemental-composition

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idslme / IDSL.UFAx

Exhaustive Formula Annotation from ions to formula

cran metabolomics mass-spectrometry lipidomics isotopic-distribution-calculations exposome molecular-formulae-assignment elemental-composition

Updated Apr 6, 2023
R

BDomzal / inks

Analysis of historical manuscripts written with iron-gall inks using LA-ICP-MS and neural networks.

machine-learning artificial-intelligence neural-networks copernicus mass-spectrometry ink multivariate-regression historical-manuscripts analytical-chemistry la-icp-ms icp-mass-spectrometer heritage-science complex-mixture elemental-composition archeometry

Updated May 21, 2026
Python

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