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End-to-end machine learning for experimental physics: using simulated data to train a neural network for object
Eric N Minor1, Stian D Howard, Adam A S Green
1Department of Physics and Soft Materials Research Center, University of Colorado, Boulder, Colorado, 80309, USA. ermi1253@colorado.edu.
Soft Matter
|January 8, 2020
Summary
We developed a novel computational method to train convolutional neural networks using simulated images. This approach significantly accelerates the analysis of experimental data, such as topological defects in liquid crystals.
Area of Science:
- Computational Physics
- Machine Learning
- Materials Science
Background:
- Modern machine learning (ML) models require extensive training datasets for accurate predictions.
- Generating large, high-quality datasets is time-consuming and often impractical for small-scale research.
- Existing methods face challenges in acquiring sufficient real-world experimental data for training ML models.
Purpose of the Study:
- To demonstrate a 'full-stack' computational solution for training convolutional neural networks (CNNs) using simulated data.
- To enable the effective application of ML models to real-world experimental data, even with limited resources.
- To address the time-intensive nature of dataset generation in ML applications.
Main Methods:
- Developed a computational framework for on-the-fly generation of simulated training data.
- Utilized a noise injection process to create simulated data representative of experimental conditions.
- Applied the trained CNN to analyze topological defect annihilation in liquid crystal freely-suspended films.
Main Results:
- The trained CNN achieved accuracy comparable to human expert annotation for defect analysis.
- Demonstrated a four-orders-of-magnitude improvement in time efficiency compared to manual analysis.
- Validated the robustness of the ML approach for analyzing spatial distribution and count of topological defects.
Conclusions:
- The 'full-stack' simulation-based training method is a powerful and efficient approach for ML applications in experimental science.
- This method significantly reduces the time investment required for dataset creation, making ML more accessible.
- The trained network provides a highly efficient and accurate tool for analyzing complex physical phenomena like topological defect dynamics.

