ArticleAnalytical chemistry2025
Rapid Copolymer Analysis of Unresolved Mass Spectra by Artificial Intelligence.
Article in Analytical chemistry, 2025. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 2 papers.
What it found
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The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.
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Who cites it
2 citing papers in PubMed.
- MALDI-TOF Mass Spectrometric Characterization of Polyacrylamide Multiblock Copolymers Reveals Structure-Property Relationships.ACS omega · 2026Article
- Reference-Free Quantitative Mass Spectrometry Enables Sequencing of Resist Copolymers and Reveals Sequence-Dependent Deprotection Sensitivity.Macromolecules · 2026Article
Corrections and comments
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Authors and funding
9 authors.
Funding
No grant is acknowledged in the PubMed record.
Abstract
In this Article, we present a novel data analysis method for the determination of copolymer composition from low-resolution mass spectra, such as those recorded in the linear mode of time-of-flight (TOF) mass analyzers. Our approach significantly extends the accessible molecular weight range, enabling reliable copolymer composition analysis even in the higher mass regions. At low resolution, the overlapping mass peaks in the higher mass range hinder a comprehensive characterization of the copolymers. Our approach, however, extracts the hidden information on the unique macromolecular chains embedded in these unresolved peaks. Regression relationships were developed between easily computable mass spectral parameters derived from the measured data and key characteristics of the copolymer structure including the average mole fraction, the number-average repeat unit count, and the monomer distribution. Two regression models were constructed: one using conventional statistical methods and the other employing a machine learning approach based on an Artificial Neural Network (ANN). The spectrum evaluation process is demonstrated for the analysis of various poly(
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Registered trials
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