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The growing computing power over the years has enabled simulations to become more complex and accurate. While immensely valuable for scientific discovery and problem-solving, however, high-fidelity simulations come with significant computational demands. As a result, it is common to run a low-fidelity model with a subgrid-scale model to reduce the computational cost, but selecting the appropriate subgrid-scale models and tuning them are challenging. We propose a novel method for learning the subgrid-scale model effects when simulating partial differential equations augmented by neural ordinary differential operators in the context of discontinuous Galerkin (DG) spatial discretization. Our approach learns the missing scales of the low-order DG solver at a continuous level and hence improves the accuracy of the low-order DG approximations as well as accelerates the filtered high-order DG simulations with a certain degree of precision. We demonstrate the performance of our approach through multidimensional Taylor-Green vortex examples at different Reynolds numbers and times, which cover laminar, transitional, and turbulent regimes. The proposed method not only reconstructs the subgrid-scale from the low-order (1st-order) approximation but also speeds up the filtered high-order DG (6th-order) simulation by two orders of magnitude.

Extremely large aperture array (ELAA) is anticipated to serve as a pivotal feature of future multiple-input multiple-output (MIMO) systems in 6G. Near-field (NF) fading channel models are essential for reliable link-level simulation and ELAA system design. In this article, we propose a framework designed to generate NF fading channels for both communication and integrated sensing and communication (ISAC) applications. The framework allows a mixed of line of sight (LoS) and non-LoS (NLoS) links. It also considers spherical wave model and spatially non-stationary shadow fading. Based on this framework, we propose a three-dimensional (3D) fading channel model for ELAA systems deployed with a uniform rectangular array (URA). It can capture the impact of sensing object for ISAC applications. Moreover, all parameters involved in the framework are based on specifications or measurements from the 3rd Generation Partnership Project (3GPP) documents. Therefore, the proposed framework and channel model have the potential to contribute to the standard in various aspects, including ISAC, extra-large (XL-) MIMO, and reconfigurable intelligent surface (RIS) aided MIMO systems. Finally, future directions for ELAA are presented, including not only NF channel modeling but also the design of next-generation transceivers.

The combination of multiple-input multiple-output (MIMO) systems and intelligent reflecting surfaces (IRSs) is foreseen as a critical enabler of beyond 5G (B5G) and 6G. In this work, two different approaches are considered for the joint optimization of the IRS phase-shift matrix and MIMO precoders of an IRS-assisted multi-stream (MS) multi-user MIMO (MU-MIMO) system. Both approaches aim to maximize the system sum-rate for every channel realization. The first proposed solution is a novel contextual bandit (CB) framework with continuous state and action spaces called deep contextual bandit-oriented deep deterministic policy gradient (DCB-DDPG). The second is an innovative deep reinforcement learning (DRL) formulation where the states, actions, and rewards are selected such that the Markov decision process (MDP) property of reinforcement learning (RL) is appropriately met. Both proposals perform remarkably better than state-of-the-art heuristic methods in scenarios with high multi-user interference.

Model generalizability to unseen datasets, concerned with in-the-wild robustness, is less studied for indoor single-image depth prediction. We leverage gradient-based meta-learning for higher generalizability on zero-shot cross-dataset inference. Unlike the most-studied image classification in meta-learning, depth is pixel-level continuous range values, and mappings from each image to depth vary widely across environments. Thus no explicit task boundaries exist. We instead propose fine-grained task that treats each RGB-D pair as a task in our meta-optimization. We first show meta-learning on limited data induces much better prior (max +29.4\%). Using meta-learned weights as initialization for following supervised learning, without involving extra data or information, it consistently outperforms baselines without the method. Compared to most indoor-depth methods that only train/ test on a single dataset, we propose zero-shot cross-dataset protocols, closely evaluate robustness, and show consistently higher generalizability and accuracy by our meta-initialization. The work at the intersection of depth and meta-learning potentially drives both research streams to step closer to practical use.

An effective multi-turn instruction-following assistant can be developed by creating a simulator that can generate useful interaction data. Apart from relying on its intrinsic weights, an ideal user simulator should also be able to bootstrap external knowledge rapidly in its raw form to simulate the multifarious diversity of text available over the internet. Previous user simulators generally lacked diversity, were mostly closed domain, and necessitated rigid schema making them inefficient to rapidly scale to incorporate external knowledge. In this regard, we introduce, Kaucus, a Knowledge-Augmented User Simulator framework, to outline a process of creating diverse user simulators, that can seamlessly exploit external knowledge as well as benefit downstream assistant model training. Through two GPT-J based simulators viz., a Retrieval Augmented Simulator and a Summary Controlled Simulator we generate diverse simulator-assistant interactions. Through reward and preference model-based evaluations, we find that these interactions serve as useful training data and create more helpful downstream assistants. We also find that incorporating knowledge through retrieval augmentation or summary control helps create better assistants.

Graph Neural Networks (GNNs) and Transformer have been increasingly adopted to learn the complex vector representations of spatio-temporal graphs, capturing intricate spatio-temporal dependencies crucial for applications such as traffic datasets. Although many existing methods utilize multi-head attention mechanisms and message-passing neural networks (MPNNs) to capture both spatial and temporal relations, these approaches encode temporal and spatial relations independently, and reflect the graph's topological characteristics in a limited manner. In this work, we introduce the Cycle to Mixer (Cy2Mixer), a novel spatio-temporal GNN based on topological non-trivial invariants of spatio-temporal graphs with gated multi-layer perceptrons (gMLP). The Cy2Mixer is composed of three blocks based on MLPs: A message-passing block for encapsulating spatial information, a cycle message-passing block for enriching topological information through cyclic subgraphs, and a temporal block for capturing temporal properties. We bolster the effectiveness of Cy2Mixer with mathematical evidence emphasizing that our cycle message-passing block is capable of offering differentiated information to the deep learning model compared to the message-passing block. Furthermore, empirical evaluations substantiate the efficacy of the Cy2Mixer, demonstrating state-of-the-art performances across various traffic benchmark datasets.

Algorithms that ensure reproducible findings from large-scale, high-dimensional data are pivotal in numerous signal processing applications. In recent years, multivariate false discovery rate (FDR) controlling methods have emerged, providing guarantees even in high-dimensional settings where the number of variables surpasses the number of samples. However, these methods often fail to reliably control the FDR in the presence of highly dependent variable groups, a common characteristic in fields such as genomics and finance. To tackle this critical issue, we introduce a novel framework that accounts for general dependency structures. Our proposed dependency-aware T-Rex selector integrates hierarchical graphical models within the T-Rex framework to effectively harness the dependency structure among variables. Leveraging martingale theory, we prove that our variable penalization mechanism ensures FDR control. We further generalize the FDR-controlling framework by stating and proving a clear condition necessary for designing both graphical and non-graphical models that capture dependencies. Additionally, we formulate a fully integrated optimal calibration algorithm that concurrently determines the parameters of the graphical model and the T-Rex framework, such that the FDR is controlled while maximizing the number of selected variables. Numerical experiments and a breast cancer survival analysis use-case demonstrate that the proposed method is the only one among the state-of-the-art benchmark methods that controls the FDR and reliably detects genes that have been previously identified to be related to breast cancer. An open-source implementation is available within the R package TRexSelector on CRAN.

Causal effect estimation from observational data is a fundamental task in empirical sciences. It becomes particularly challenging when unobserved confounders are involved in a system. This paper focuses on front-door adjustment -- a classic technique which, using observed mediators allows to identify causal effects even in the presence of unobserved confounding. While the statistical properties of the front-door estimation are quite well understood, its algorithmic aspects remained unexplored for a long time. In 2022, Jeong, Tian, and Bareinboim presented the first polynomial-time algorithm for finding sets satisfying the front-door criterion in a given directed acyclic graph (DAG), with an $O(n^3(n+m))$ run time, where $n$ denotes the number of variables and $m$ the number of edges of the causal graph. In our work, we give the first linear-time, i.e., $O(n+m)$, algorithm for this task, which thus reaches the asymptotically optimal time complexity. This result implies an $O(n(n+m))$ delay enumeration algorithm of all front-door adjustment sets, again improving previous work by a factor of $n^3$. Moreover, we provide the first linear-time algorithm for finding a minimal front-door adjustment set. We offer implementations of our algorithms in multiple programming languages to facilitate practical usage and empirically validate their feasibility, even for large graphs.

Neural networks are vulnerable to adversarial attacks, i.e., small input perturbations can result in substantially different outputs of a neural network. Safety-critical environments require neural networks that are robust against input perturbations. However, training and formally verifying robust neural networks is challenging. We address this challenge by employing, for the first time, a end-to-end set-based training procedure that trains robust neural networks for formal verification. Our training procedure drastically simplifies the subsequent formal robustness verification of the trained neural network. While previous research has predominantly focused on augmenting neural network training with adversarial attacks, our approach leverages set-based computing to train neural networks with entire sets of perturbed inputs. Moreover, we demonstrate that our set-based training procedure effectively trains robust neural networks, which are easier to verify. In many cases, set-based trained neural networks outperform neural networks trained with state-of-the-art adversarial attacks.

Multi-relation Question Answering is a challenging task, due to the requirement of elaborated analysis on questions and reasoning over multiple fact triples in knowledge base. In this paper, we present a novel model called Interpretable Reasoning Network that employs an interpretable, hop-by-hop reasoning process for question answering. The model dynamically decides which part of an input question should be analyzed at each hop; predicts a relation that corresponds to the current parsed results; utilizes the predicted relation to update the question representation and the state of the reasoning process; and then drives the next-hop reasoning. Experiments show that our model yields state-of-the-art results on two datasets. More interestingly, the model can offer traceable and observable intermediate predictions for reasoning analysis and failure diagnosis.