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Inverse Modeling for Artifact Removal in Photonic Data: A Computational Physics and Transfer Learning-Based Approach
Ravi Teja Vulchi1, Volodymyr Morgunov1, Julian Hniopek2
1Institute of Physical Chemistry (IPC) and Abbe Center of Photonics (ACP), Friedrich Schiller University Jena, Member of the Leibniz Centre for Photonics in Infection Research (LPI), Helmholtzweg 4, Jena 07743, Germany.
Journal of Chemical Information and Modeling
|October 28, 2025
Summary
This study introduces a deep learning framework to correct etaloning artifacts in spectroscopic data. The method significantly improves spectral accuracy and interpretability by reducing distortions up to 70%.
Area of Science:
- Spectroscopy
- Computational Physics
- Deep Learning
Background:
- Etaloning artifacts cause significant distortions in spectroscopic data.
- These distortions complicate data analysis and interpretation.
- Accurate spectral data is crucial for scientific discovery.
Purpose of the Study:
- To develop an inverse modeling framework to correct etaloning artifacts.
- To improve the accuracy and interpretability of spectroscopic data.
- To leverage deep learning and computational physics for spectral data correction.
Main Methods:
- An inverse modeling framework integrating computational physics and deep learning was developed.
- A two-phase transfer learning strategy was employed: pretraining on simulated spectra and fine-tuning on experimental data.
- Over 30,000 simulated spectra were generated using the transfer matrix method for pretraining.
Main Results:
- The transfer learning approach reduced etaloning-induced distortions by up to 70%.
- The model demonstrated enhanced generalization across different sensor designs.
- Cross-validation across multiple devices confirmed significant improvements in spectral accuracy and interpretability.
Conclusions:
- The developed framework effectively corrects etaloning artifacts in spectroscopic data.
- This approach sets a new standard for achieving reliable spectral data.
- Combining correction procedures with physics simulations enhances spectral data quality.

