phepy: Visual Benchmarks and Improvements for Out-of-Distribution Detectors

Applying machine learning to increasingly high-dimensional problems with sparse or biased training data increases the risk that a model is used on inputs outside its training domain. For such out-of-distribution (OOD) inputs, the model can no longer make valid predictions, and its error is potentially unbounded. Testing OOD detection methods on real-world datasets is complicated by the ambiguity around which inputs are in-distribution (ID) or OOD. We design a benchmark for OOD detection, which includes three novel and easily-visualisable toy examples. These simple examples provide direct and intuitive insight into whether the detector is able to detect (1) linear and (2) non-linear concepts and (3) identify thin ID subspaces (needles) within high-dimensional spaces (haystacks). We use our benchmark to evaluate the performance of various methods from the literature. Since tactile examples of OOD inputs may benefit OOD detection, we also review several simple methods to synthesise OOD inputs for supervised training. We introduce two improvements, $t$-poking and OOD sample weighting, to make supervised detectors more precise at the ID-OOD boundary. This is especially important when conflicts between real ID and synthetic OOD sample blur the decision boundary. Finally, we provide recommendations for constructing and applying out-of-distribution detectors in machine learning.

Cellular Automaton With CNN

Cellular automata (CA) models are widely used to simulate complex systems with emergent behaviors, but identifying hidden parameters that govern their dynamics remains a significant challenge. This study explores the use of Convolutional Neural Networks (CNN) to identify jump parameters in a two-dimensional CA model. We propose a custom CNN architecture trained on CA-generated data to classify jump parameters, which dictates the neighborhood size and movement rules of cells within the CA. Experiments were conducted across varying domain sizes (25 x 25 to 150 x 150) and CA iterations (0 to 50), demonstrating that the accuracy improves with larger domain sizes, as they provide more spatial information for parameter estimation. Interestingly, while initial CA iterations enhance the performance, increasing the number of iterations beyond a certain threshold does not significantly improve accuracy, suggesting that only specific temporal information is relevant for parameter identification. The proposed CNN achieves competitive accuracy (89.31) compared to established architectures like LeNet-5 and AlexNet, while offering significantly faster inference times, making it suitable for real-time applications. This study highlights the potential of CNNs as a powerful tool for fast and accurate parameter estimation in CA models, paving the way for their use in more complex systems and higher-dimensional domains. Future work will explore the identification of multiple hidden parameters and extend the approach to three-dimensional CA models.

Data-Efficient Limited-Angle CT Using Deep Priors and Regularization

Reconstructing an image from its Radon transform is a fundamental computed tomography (CT) task arising in applications such as X-ray scans. In many practical scenarios, a full 180-degree scan is not feasible, or there is a desire to reduce radiation exposure. In these limited-angle settings, the problem becomes ill-posed, and methods designed for full-view data often leave significant artifacts. We propose a very low-data approach to reconstruct the original image from its Radon transform under severe angle limitations. Because the inverse problem is ill-posed, we combine multiple regularization methods, including Total Variation, a sinogram filter, Deep Image Prior, and a patch-level autoencoder. We use a differentiable implementation of the Radon transform, which allows us to use gradient-based techniques to solve the inverse problem. Our method is evaluated on a dataset from the Helsinki Tomography Challenge 2022, where the goal is to reconstruct a binary disk from its limited-angle sinogram. We only use a total of 12 data points--eight for learning a prior and four for hyperparameter selection--and achieve results comparable to the best synthetic data-driven approaches.

Super-Resolution works for coastal simulations

Learning fine-scale details of a coastal ocean simulation from a coarse representation is a challenging task. For real-world applications, high-resolution simulations are necessary to advance understanding of many coastal processes, specifically, to predict flooding resulting from tsunamis and storm surges. We propose a Deep Network for Coastal Super-Resolution (DNCSR) for spatiotemporal enhancement to efficiently learn the high-resolution numerical solution. Given images of coastal simulations produced on low-resolution computational meshes using low polynomial order discontinuous Galerkin discretizations and a coarse temporal resolution, the proposed DNCSR learns to produce high-resolution free surface elevation and velocity visualizations in both time and space. To efficiently model the dynamic changes over time and space, we propose grid-aware spatiotemporal attention to project the temporal features to the spatial domain for non-local feature matching. The coordinate information is also utilized via positional encoding. For the final reconstruction, we use the spatiotemporal bilinear operation to interpolate the missing frames and then expand the feature maps to the frequency domain for residual mapping. Besides data-driven losses, the proposed physics-informed loss guarantees gradient consistency and momentum changes. Their combination contributes to the overall 24% improvements in RMSE. To train the proposed model, we propose a large-scale coastal simulation dataset and use it for model optimization and evaluation. Our method shows superior super-resolution quality and fast computation compared to the state-of-the-art methods.