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Correcting systematic errors by hybrid 2D correlation loss functions in nonlinear inverse modelling

Recently a new family of loss functions called smart error sums has been suggested. These loss functions account for correlations within experimental data and force modeled data to obey these correlations. As a result, multiplicative systematic errors of experimental data can be revealed and correct...

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Autores principales: Mayerhöfer, Thomas G., Noda, Isao, Pahlow, Susanne, Heintzmann, Rainer, Popp, Jürgen
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10118180/
https://www.ncbi.nlm.nih.gov/pubmed/37079649
http://dx.doi.org/10.1371/journal.pone.0284723
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author Mayerhöfer, Thomas G.
Noda, Isao
Pahlow, Susanne
Heintzmann, Rainer
Popp, Jürgen
author_facet Mayerhöfer, Thomas G.
Noda, Isao
Pahlow, Susanne
Heintzmann, Rainer
Popp, Jürgen
author_sort Mayerhöfer, Thomas G.
collection PubMed
description Recently a new family of loss functions called smart error sums has been suggested. These loss functions account for correlations within experimental data and force modeled data to obey these correlations. As a result, multiplicative systematic errors of experimental data can be revealed and corrected. The smart error sums are based on 2D correlation analysis which is a comparably recent methodology for analyzing spectroscopic data that has found broad application. In this contribution we mathematically generalize and break down this methodology and the smart error sums to uncover the mathematic roots and simplify it to craft a general tool beyond spectroscopic modelling. This reduction also allows a simplified discussion about limits and prospects of this new method including one of its potential future uses as a sophisticated loss function in deep learning. To support its deployment, the work includes computer code to allow reproduction of the basic results.
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spelling pubmed-101181802023-04-21 Correcting systematic errors by hybrid 2D correlation loss functions in nonlinear inverse modelling Mayerhöfer, Thomas G. Noda, Isao Pahlow, Susanne Heintzmann, Rainer Popp, Jürgen PLoS One Research Article Recently a new family of loss functions called smart error sums has been suggested. These loss functions account for correlations within experimental data and force modeled data to obey these correlations. As a result, multiplicative systematic errors of experimental data can be revealed and corrected. The smart error sums are based on 2D correlation analysis which is a comparably recent methodology for analyzing spectroscopic data that has found broad application. In this contribution we mathematically generalize and break down this methodology and the smart error sums to uncover the mathematic roots and simplify it to craft a general tool beyond spectroscopic modelling. This reduction also allows a simplified discussion about limits and prospects of this new method including one of its potential future uses as a sophisticated loss function in deep learning. To support its deployment, the work includes computer code to allow reproduction of the basic results. Public Library of Science 2023-04-20 /pmc/articles/PMC10118180/ /pubmed/37079649 http://dx.doi.org/10.1371/journal.pone.0284723 Text en © 2023 Mayerhöfer et al https://creativecommons.org/licenses/by/4.0/This is an open access article distributed under the terms of the Creative Commons Attribution License (https://creativecommons.org/licenses/by/4.0/) , which permits unrestricted use, distribution, and reproduction in any medium, provided the original author and source are credited.
spellingShingle Research Article
Mayerhöfer, Thomas G.
Noda, Isao
Pahlow, Susanne
Heintzmann, Rainer
Popp, Jürgen
Correcting systematic errors by hybrid 2D correlation loss functions in nonlinear inverse modelling
title Correcting systematic errors by hybrid 2D correlation loss functions in nonlinear inverse modelling
title_full Correcting systematic errors by hybrid 2D correlation loss functions in nonlinear inverse modelling
title_fullStr Correcting systematic errors by hybrid 2D correlation loss functions in nonlinear inverse modelling
title_full_unstemmed Correcting systematic errors by hybrid 2D correlation loss functions in nonlinear inverse modelling
title_short Correcting systematic errors by hybrid 2D correlation loss functions in nonlinear inverse modelling
title_sort correcting systematic errors by hybrid 2d correlation loss functions in nonlinear inverse modelling
topic Research Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10118180/
https://www.ncbi.nlm.nih.gov/pubmed/37079649
http://dx.doi.org/10.1371/journal.pone.0284723
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