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Graph Neural Networks (GNNs) have become essential tools for analyzing graph-structured data in domains such as drug discovery and financial analysis, leading to growing demands for model transparency. Recent advances in explainable GNNs…

Machine Learning · Computer Science 2025-06-04 Bin Ma , Yuyuan Feng , Minhua Lin , Enyan Dai

Uncovering rationales behind predictions of graph neural networks (GNNs) has received increasing attention over recent years. Instance-level GNN explanation aims to discover critical input elements, like nodes or edges, that the target GNN…

Machine Learning · Computer Science 2022-12-20 Tianxiang Zhao , Dongsheng Luo , Xiang Zhang , Suhang Wang

Algorithms have been fundamental to recent global technological advances and, in particular, they have been the cornerstone of technical advances in one field rapidly being applied to another. We argue that algorithms possess fundamentally…

Machine Learning · Computer Science 2021-08-09 Petar Veličković , Charles Blundell

Mechanistic interpretability (MI) is an emerging sub-field of interpretability that seeks to understand a neural network model by reverse-engineering its internal computations. Recently, MI has garnered significant attention for…

Artificial Intelligence · Computer Science 2025-10-14 Daking Rai , Yilun Zhou , Shi Feng , Abulhair Saparov , Ziyu Yao

Mechanistic interpretability research seeks to reveal the inner workings of large language models, yet most work focuses on classification or generative tasks rather than summarization. This paper presents an interpretability framework for…

Computation and Language · Computer Science 2025-05-26 Anurag Mishra

While Annealing Machines (AM) have shown increasing capabilities in solving complex combinatorial problems, positioning themselves as a more immediate alternative to the expected advances of future fully quantum solutions, there are still…

Artificial Intelligence · Computer Science 2025-01-13 Pablo Loyola , Kento Hasegawa , Andres Hoyos-Idobro , Kazuo Ono , Toyotaro Suzumura , Yu Hirate , Masanao Yamaoka

Practical use of neural networks often involves requirements on latency, energy and memory among others. A popular approach to find networks under such requirements is through constrained Neural Architecture Search (NAS). However, previous…

Machine Learning · Computer Science 2022-04-28 Niv Nayman , Yonathan Aflalo , Asaf Noy , Rong Jin , Lihi Zelnik-Manor

Human brains lie at the core of complex neurobiological systems, where the neurons, circuits, and subsystems interact in enigmatic ways. Understanding the structural and functional mechanisms of the brain has long been an intriguing pursuit…

Neurons and Cognition · Quantitative Biology 2022-07-26 Hejie Cui , Wei Dai , Yanqiao Zhu , Xiaoxiao Li , Lifang He , Carl Yang

We find arithmetic ability resides within a limited number of attention heads, with each head specializing in distinct operations. To delve into the reason, we introduce the Comparative Neuron Analysis (CNA) method, which identifies an…

Computation and Language · Computer Science 2024-09-24 Zeping Yu , Sophia Ananiadou

Recurrent neural networks have achieved remarkable success at generating sequences with complex structures, thanks to advances that include richer embeddings of input and cures for vanishing gradients. Trained only on sequences from a known…

Artificial Intelligence · Computer Science 2021-10-28 Matthew Amodio , Swarat Chaudhuri , Thomas W. Reps

Arbitrarily Applicable Relational Responding (AARR) is a cornerstone of human language and reasoning, referring to the learned ability to relate symbols in flexible, context-dependent ways. In this paper, we present a novel theoretical…

Artificial Intelligence · Computer Science 2025-03-04 Robert Johansson

Graph Neural Networks (GNNs) are widely used for node classification, yet their opaque decision-making limits trust and adoption. While local explanations offer insights into individual predictions, global explanation methods, those that…

Machine Learning · Computer Science 2025-10-30 Burouj Armgaan , Eshan Jain , Harsh Pandey , Mahesh Chandran , Sayan Ranu

LLMs have demonstrated remarkable capabilities in complex reasoning tasks, yet they often suffer from hallucinations and lack reliable factual grounding. Meanwhile, knowledge graphs (KGs) provide structured factual knowledge but lack the…

Computation and Language · Computer Science 2025-05-28 Xiangqing Shen , Fanfan Wang , Rui Xia

Artificial Neural Networks (ANNs) are powerful machine-learning models capable of capturing intricate non-linear relationships. They are widely used nowadays across numerous scientific and engineering domains, driving advancements in both…

Artificial Intelligence · Computer Science 2026-05-05 Theofanis Aravanis

Graph neural networks (GNNs) are the predominant approach for graph-based machine learning. While neural networks have shown great performance at learning useful representations, they are often criticized for their limited high-level…

Machine Learning · Computer Science 2024-07-09 Markus Zopf , Francesco Alesiani

The ubiquity of neural networks (NNs) in real-world applications, from healthcare to natural language processing, underscores their immense utility in capturing complex relationships within high-dimensional data. However, NNs come with…

Machine Learning · Computer Science 2024-07-08 Chang Yue , Niraj K. Jha

Network regularization is an effective tool for incorporating structural prior knowledge to learn coherent models over networks, and has yielded provably accurate estimates in applications ranging from spatial economics to neuroimaging…

Machine Learning · Computer Science 2020-06-02 Hongyuan You , Furkan Kocayusufoglu , Ambuj K. Singh

Compositional relational reasoning (CRR) is a hallmark of human intelligence, but we lack a clear understanding of whether and how existing transformer large language models (LLMs) can solve CRR tasks. To enable systematic exploration of…

Computation and Language · Computer Science 2024-12-18 Ruikang Ni , Da Xiao , Qingye Meng , Xiangyu Li , Shihui Zheng , Hongliang Liang

Understanding AI systems' inner workings is critical for ensuring value alignment and safety. This review explores mechanistic interpretability: reverse engineering the computational mechanisms and representations learned by neural networks…

Artificial Intelligence · Computer Science 2024-08-27 Leonard Bereska , Efstratios Gavves

Currently, Deep Learning (DL) components within a Case-Based Reasoning (CBR) application often lack the comprehensive integration of available domain knowledge. The trend within machine learning towards so-called Informed machine learning…

Artificial Intelligence · Computer Science 2021-07-01 Maximilian Hoffmann , Ralph Bergmann