Neural Information Processing Systems http://nips.cc/

Inspired by the success of autoregressive priors in probabilistic generative models,weexamineautoregressive,hierarchical, andcombined priorsasalternatives, weighing their costs and benefits in the context of image compression.

This paper introduces an Artificial Intelligence (AI) foundation model for time series in engineering applications, where causal operations are required for real-time monitoring and control. Since engineering time series are governed by physical, rather than linguistic, laws, large-language-model-based AI foundation models may be ineffective or inefficient. Building on the classical innovations representation theory of Wiener, Kallianpur, and Rosenblatt, we propose Time Series GPT (TS-GPT) -- an innovations-representation-based Generative Pre-trained Transformer for engineering monitoring and control. As an example of foundation model adaptation, we consider Probabilistic Generative Forecasting, which produces future time series samples from conditional probability distributions given past realizations. We demonstrate the effectiveness of TS-GPT in forecasting real-time locational marginal prices using historical data from U.S. independent system operators.

Abstract--Manifold alignment (MA) involves a set of techniques for learning shared representations across domains, yet many traditional MA methods are incapable of performing out-of-sample extension, limiting their real-world applicability. We propose a guided representation learning framework leveraging a geometry-regularized twin autoencoder (AE) architecture to enhance MA while enabling generalization to unseen data. Our method enforces structured cross-modal mappings to maintain geometric fidelity in learned embeddings. By incorporating a pre-trained alignment model and a multitask learning formulation, we improve cross-domain generalization and representation robustness while maintaining alignment fidelity. We evaluate our approach using several MA methods, showing improvements in embedding consistency, information preservation, and cross-domain transfer . Additionally, we apply our framework to Alzheimer's disease diagnosis, demonstrating its ability to integrate multi-modal patient data and enhance predictive accuracy in cases limited to a single domain by leveraging insights from the multi-modal problem. Manifold learning encompasses a set of methods used to create a lower-dimensional representation, or an embedding, of higher-dimensional data. Such representations can form a key role in data visualization [1]-[5], dimensionality reduction as a preprocessing step for subsequent machine-learning or analytical tasks [6], or serve as a denoising mechanism [4]. In the context of multi-domain problems, where multiple types of data are considered, manifold learning becomes more challenging as data distributions across different domains or modalities may exhibit domain-specific variations while still sharing a common geometric structure. Manifold alignment (MA) seeks to address this problem. In some contexts, a common, shared representation of multi-modal data can be viewed as a natural extension of manifold learning. For example, cell samples of the same type but collected at a different time or using different methodologies should still share features in common, but differences in the measured features may occur due to batch effects [7], obscuring the similarities.

Recent advances in generative artificial intelligence applications have raised new data security concerns. This paper focuses on defending diffusion models against membership inference attacks. This type of attack occurs when the attacker can determine if a certain data point was used to train the model. Although diffusion models are intrinsically more resistant to membership inference attacks than other generative models, they are still susceptible. The defense proposed here utilizes critically-damped higher-order Langevin dynamics, which introduces several auxiliary variables and a joint diffusion process along these variables. The idea is that the presence of auxiliary variables mixes external randomness that helps to corrupt sensitive input data earlier on in the diffusion process. This concept is theoretically investigated and validated on a toy dataset and a speech dataset using the Area Under the Receiver Operating Characteristic (AUROC) curves and the FID metric.

Estimating heterogeneous treatment effects is critical in domains such as personalized medicine, resource allocation, and policy evaluation. A central challenge lies in identifying subpopulations that respond differently to interventions, thereby enabling more targeted and effective decision-making. While clustering methods are well-studied in unsupervised learning, their integration with causal inference remains limited. We propose a novel framework that clusters individuals based on estimated treatment effects using a learned kernel derived from causal forests, revealing latent subgroup structures. Our approach consists of two main steps. First, we estimate debiased Conditional Average Treatment Effects (CATEs) using orthogonalized learners via the Robinson decomposition, yielding a kernel matrix that encodes sample-level similarities in treatment responsiveness. Second, we apply kernelized clustering to this matrix to uncover distinct, treatment-sensitive subpopulations and compute cluster-level average CATEs. We present this kernelized clustering step as a form of regularization within the residual-on-residual regression framework. Through extensive experiments on semi-synthetic and real-world datasets, supported by ablation studies and exploratory analyses, we demonstrate the effectiveness of our method in capturing meaningful treatment effect heterogeneity.

Offline reinforcement learning (offline RL) offers a promising framework for developing control strategies in chemical process systems using historical data, without the risks or costs of online experimentation. This work investigates the application of offline RL to the safe and efficient control of an exothermic polymerisation continuous stirred-tank reactor. We introduce a Gymnasium-compatible simulation environment that captures the reactor's nonlinear dynamics, including reaction kinetics, energy balances, and operational constraints. The environment supports three industrially relevant scenarios: startup, grade change down, and grade change up. It also includes reproducible offline datasets generated from proportional-integral controllers with randomised tunings, providing a benchmark for evaluating offline RL algorithms in realistic process control tasks. We assess behaviour cloning and implicit Q-learning as baseline algorithms, highlighting the challenges offline agents face, including steady-state offsets and degraded performance near setpoints. To address these issues, we propose a novel deployment-time safety layer that performs gradient-based action correction using input convex neural networks (PICNNs) as learned cost models. The PICNN enables real-time, differentiable correction of policy actions by descending a convex, state-conditioned cost surface, without requiring retraining or environment interaction. Experimental results show that offline RL, particularly when combined with convex action correction, can outperform traditional control approaches and maintain stability across all scenarios. These findings demonstrate the feasibility of integrating offline RL with interpretable and safety-aware corrections for high-stakes chemical process control, and lay the groundwork for more reliable data-driven automation in industrial systems.

This research addresses the critical lack of comprehensive studies on feature scaling by systematically evaluating 12 scaling techniques - including several less common transformations - across 14 different Machine Learning algorithms and 16 datasets for classification and regression tasks. We meticulously analyzed impacts on predictive performance (using metrics such as accuracy, MAE, MSE, and $R^2$) and computational costs (training time, inference time, and memory usage). Key findings reveal that while ensemble methods (such as Random Forest and gradient boosting models like XGBoost, CatBoost and LightGBM) demonstrate robust performance largely independent of scaling, other widely used models such as Logistic Regression, SVMs, TabNet, and MLPs show significant performance variations highly dependent on the chosen scaler. This extensive empirical analysis, with all source code, experimental results, and model parameters made publicly available to ensure complete transparency and reproducibility, offers model-specific crucial guidance to practitioners on the need for an optimal selection of feature scaling techniques.

In this work, we employ neural fields, which use neural networks to map a coordinate to the corresponding physical property value at that coordinate, in a test-time learning manner. For a test-time learning method, the weights are learned during the inversion, as compared to traditional approaches which require a network to be trained using a training data set. Results for synthetic examples in seismic tomography and direct current resistivity inversions are shown first. We then perform a singular value decomposition analysis on the Jacobian of the weights of the neural network (SVD analysis) for both cases to explore the effects of neural networks on the recovered model. The results show that the test-time learning approach can eliminate unwanted artifacts in the recovered subsurface physical property model caused by the sensitivity of the survey and physics. Therefore, NFs-Inv improves the inversion results compared to the conventional inversion in some cases such as the recovery of the dip angle or the prediction of the boundaries of the main target. In the SVD analysis, we observe similar patterns in the left-singular vectors as were observed in some diffusion models, trained in a supervised manner, for generative tasks in computer vision. This observation provides evidence that there is an implicit bias, which is inherent in neural network structures, that is useful in supervised learning and test-time learning models. This implicit bias has the potential to be useful for recovering models in geophysical inversions.

Fully decentralized, safe, and deadlock-free multi-robot navigation in dynamic, cluttered environments is a critical challenge in robotics. Current methods require exact state measurements in order to enforce safety and liveness e.g. via control barrier functions (CBFs), which is challenging to achieve directly from onboard sensors like lidars and cameras. This work introduces LIVEPOINT, a decentralized control framework that synthesizes universal CBFs over point clouds to enable safe, deadlock-free real-time multi-robot navigation in dynamic, cluttered environments. Further, LIVEPOINT ensures minimally invasive deadlock avoidance behavior by dynamically adjusting agents' speeds based on a novel symmetric interaction metric. We validate our approach in simulation experiments across highly constrained multi-robot scenarios like doorways and intersections. Results demonstrate that LIVEPOINT achieves zero collisions or deadlocks and a 100% success rate in challenging settings compared to optimization-based baselines such as MPC and ORCA and neural methods such as MPNet, which fail in such environments. Despite prioritizing safety and liveness, LIVEPOINT is 35% smoother than baselines in the doorway environment, and maintains agility in constrained environments while still being safe and deadlock-free.