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Sparse, self-organizing ensembles of local kernels detect rare statistical anomalies

Grosso, Gaia, Hindupur, Sai Sumedh R., Fel, Thomas, Bright-Thonney, Samuel, Harris, Philip, Ba, Demba

arXiv.org Artificial Intelligence

Modern artificial intelligence has revolutionized our ability to extract rich and versatile data representations across scientific disciplines. Yet, the statistical properties of these representations remain poorly controlled, causing misspecified anomaly detection (AD) methods to falter. Weak or rare signals can remain hidden within the apparent regularity of normal data, creating a gap in our ability to detect and interpret anomalies. We examine this gap and identify a set of structural desiderata for detection methods operating under minimal prior information: sparsity, to enforce parsimony; locality, to preserve geometric sensitivity; and competition, to promote efficient allocation of model capacity. These principles define a class of self-organizing local kernels that adaptively partition the representation space around regions of statistical imbalance. As an instantiation of these principles, we introduce SparKer, a sparse ensemble of Gaussian kernels trained within a semi-supervised Neyman--Pearson framework to locally model the likelihood ratio between a sample that may contain anomalies and a nominal, anomaly-free reference. We provide theoretical insights into the mechanisms that drive detection and self-organization in the proposed model, and demonstrate the effectiveness of this approach on realistic high-dimensional problems of scientific discovery, open-world novelty detection, intrusion detection, and generative-model validation. Our applications span both the natural- and computer-science domains. We demonstrate that ensembles containing only a handful of kernels can identify statistically significant anomalous locations within representation spaces of thousands of dimensions, underscoring both the interpretability, efficiency and scalability of the proposed approach.


AutoSciDACT: Automated Scientific Discovery through Contrastive Embedding and Hypothesis Testing

Bright-Thonney, Samuel, Reissel, Christina, Grosso, Gaia, Woodward, Nathaniel, Govorkova, Katya, Novak, Andrzej, Park, Sang Eon, Moreno, Eric, Harris, Philip

arXiv.org Machine Learning

Novelty detection in large scientific datasets faces two key challenges: the noisy and high-dimensional nature of experimental data, and the necessity of making statistically robust statements about any observed outliers. While there is a wealth of literature on anomaly detection via dimensionality reduction, most methods do not produce outputs compatible with quantifiable claims of scientific discovery. In this work we directly address these challenges, presenting the first step towards a unified pipeline for novelty detection adapted for the rigorous statistical demands of science. We introduce AutoSciDACT (Automated Scientific Discovery with Anomalous Contrastive Testing), a general-purpose pipeline for detecting novelty in scientific data. AutoSciDACT begins by creating expressive low-dimensional data representations using a contrastive pre-training, leveraging the abundance of high-quality simulated data in many scientific domains alongside expertise that can guide principled data augmentation strategies. These compact embeddings then enable an extremely sensitive machine learning-based two-sample test using the New Physics Learning Machine (NPLM) framework, which identifies and statistically quantifies deviations in observed data relative to a reference distribution (null hypothesis). We perform experiments across a range of astronomical, physical, biological, image, and synthetic datasets, demonstrating strong sensitivity to small injections of anomalous data across all domains.




Evaluating Large Language Models for IUCN Red List Species Information

Uryu, Shinya

arXiv.org Artificial Intelligence

Large Language Models (LLMs) are rapidly being adopted in conservation to address the biodiversity crisis, yet their reliability for species evaluation is uncertain. This study systematically validates five leading models on 21,955 species across four core IUCN Red List assessment components: taxonomy, conservation status, distribution, and threats. A critical paradox was revealed: models excelled at taxonomic classification (94.9%) but consistently failed at conservation reasoning (27.2% for status assessment). This knowledge-reasoning gap, evident across all models, suggests inherent architectural constraints, not just data limitations. Furthermore, models exhibited systematic biases favoring charismatic vertebrates, potentially amplifying existing conservation inequities. These findings delineate clear boundaries for responsible LLM deployment: they are powerful tools for information retrieval but require human oversight for judgment-based decisions. A hybrid approach is recommended, where LLMs augment expert capacity while human experts retain sole authority over risk assessment and policy.


Local Mixtures of Experts: Essentially Free Test-Time Training via Model Merging

Bertolissi, Ryo, Hübotter, Jonas, Hakimi, Ido, Krause, Andreas

arXiv.org Artificial Intelligence

Mixture of expert (MoE) models are a promising approach to increasing model capacity without increasing inference cost, and are core components of many state-of-the-art language models. However, current MoE models typically use only few experts due to prohibitive training and inference cost. We propose Test-Time Model Merging (TTMM) which scales the MoE paradigm to an order of magnitude more experts and uses model merging to avoid almost any test-time overhead. We show that TTMM is an approximation of test-time training (TTT), which fine-tunes an expert model for each prediction task, i.e., prompt. TTT has recently been shown to significantly improve language models, but is computationally expensive. We find that performance of TTMM improves with more experts and approaches the performance of TTT. Moreover, we find that with a 1B parameter base model, TTMM is more than 100x faster than TTT at test-time by amortizing the cost of TTT at train-time. Thus, TTMM offers a promising cost-effective approach to scale test-time training.


Deep learning four decades of human migration

Gaskin, Thomas, Abel, Guy J.

arXiv.org Artificial Intelligence

W e present a novel and detailed dataset on origin-destination annual migration flows and stocks between 230 countries and regions, spanning the period from 1990 to the present. Our flow estimates are further disaggregated by country of birth, providing a comprehensive picture of migration over the last 35 years. The estimates are obtained by training a deep recurrent neural network to learn flow patterns from 18 covariates for all countries, including geographic, economic, cultural, societal, and political information. The recurrent architecture of the neural network means that the entire past can influence current migration patterns, allowing us to learn long-range temporal correlations. By training an ensemble of neural networks and additionally pushing uncertainty on the covariates through the trained network, we obtain confidence bounds for all our estimates, allowing researchers to pinpoint the geographic regions most in need of additional data collection. W e validate our approach on various test sets of unseen data, demonstrating that it significantly outperforms traditional methods estimating five-year flows while delivering a significant increase in temporal resolution. The model is fully open source: all training data, neural network weights, and training code are made public alongside the migration estimates, providing a valuable resource for future studies of human migration.


Fine-Scale Soil Mapping in Alaska with Multimodal Machine Learning

Lin, Yijun, Chen, Theresa, Brungard, Colby, Sabine, Grunwald, Ives, Sue, Macander, Matt, Nawrocki, Timm, Chiang, Yao-Yi, Jelinski, Nic

arXiv.org Artificial Intelligence

Fine-scale soil mapping in Alaska, traditionally relying on fieldwork and localized simulations, remains a critical yet underdeveloped task, despite the region's ecological importance and extensive permafrost coverage. As permafrost thaw accelerates due to climate change, it threatens infrastructure stability and key ecosystem services, such as soil carbon storage. High-resolution soil maps are essential for characterizing permafrost distribution, identifying vulnerable areas, and informing adaptation strategies. We present MISO, a vision-based machine learning (ML) model to produce statewide fine-scale soil maps for near-surface permafrost and soil taxonomy. The model integrates a geospatial foundation model for visual feature extraction, implicit neural representations for continuous spatial prediction, and contrastive learning for multimodal alignment and geo-location awareness. We compare MISO with Random Forest (RF), a traditional ML model that has been widely used in soil mapping applications. Spatial cross-validation and regional analysis across Permafrost Zones and Major Land Resource Areas (MLRAs) show that MISO generalizes better to remote, unseen locations and achieves higher recall than RF, which is critical for monitoring permafrost thaw and related environmental processes. These findings demonstrate the potential of advanced ML approaches for fine-scale soil mapping and provide practical guidance for future soil sampling and infrastructure planning in permafrost-affected landscapes. The project will be released at https://github.com/knowledge-computing/Peatland-permafrost.