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We challenge black-box purely deep neural approaches for molecules and graph generation, which are limited in controllability and lack formal guarantees. We introduce Neuro-Symbolic Graph Generative Modeling (NSGGM), a neurosymbolic…

机器学习 · 计算机科学 2026-02-25 Chuqin Geng , Li Zhang , Mark Zhang , Haolin Ye , Ziyu Zhao , Xujie Si

Deeper and wider CNNs are known to provide improved performance for deep learning tasks. However, most such networks have poor performance gain per parameter increase. In this paper, we investigate whether the gain observed in deeper models…

计算机视觉与模式识别 · 计算机科学 2021-08-20 Arnav Chavan , Udbhav Bamba , Rishabh Tiwari , Deepak Gupta

This work presents a novel means for understanding learning dynamics and scaling relations in neural networks. We show that certain measures on the spectrum of the empirical neural tangent kernel, specifically entropy and trace, yield…

机器学习 · 计算机科学 2024-10-11 Samuel Tovey , Sven Krippendorf , Michael Spannowsky , Konstantin Nikolaou , Christian Holm

Graph convolutional neural networks (GCNs) generalize tradition convolutional neural networks (CNNs) from low-dimensional regular graphs (e.g., image) to high dimensional irregular graphs (e.g., text documents on word embeddings). Due to…

机器学习 · 计算机科学 2021-03-30 Mehrnaz Najafi , Philip S. Yu

As a popular machine learning method, neural networks can be used to solve many complex tasks. Their strong generalization ability comes from the representation ability of the basic neuron model. The most popular neuron is the MP neuron,…

机器学习 · 计算机科学 2020-11-24 Junyi An , Fengshan Liu , Jian Zhao , Furao Shen

Sensory perception (e.g. vision) relies on a hierarchy of cortical areas, in which neural activity propagates in both directions, to convey information not only about sensory inputs but also about cognitive states, expectations and…

神经元与认知 · 定量生物学 2023-04-13 Grégory Faye , Guilhem Fouilhé , Rufin VanRullen

Understanding how the brain learns to compute functions reliably, efficiently and robustly with noisy spiking activity is a fundamental challenge in neuroscience. Most sensory and motor tasks can be described as dynamical systems and could…

神经元与认知 · 定量生物学 2017-05-24 Sophie Denève , Alireza Alemi , Ralph Bourdoukan

Expressivity plays a fundamental role in evaluating deep neural networks, and it is closely related to understanding the limit of performance improvement. In this paper, we propose a three-pipeline training framework based on critical…

机器学习 · 计算机科学 2020-12-17 Gege Zhang

Artificial and biological agents cannon learn given completely random and unstructured data. The structure of data is encoded in the metric relationships between data points. In the context of neural networks, neuronal activity within a…

机器学习 · 计算机科学 2022-11-03 Kosio Beshkov , Jonas Verhellen , Mikkel Elle Lepperød

Generative modeling of graphs with spatial structure is essential across many applications from computer graphics to spatial genomics. Recent flow-based generative models have achieved impressive results by gradually adding and then…

机器学习 · 计算机科学 2025-07-15 Peter Pao-Huang , Mitchell Black , Xiaojie Qiu

Convolutional networks have achieved great success in various vision tasks. This is mainly due to a considerable amount of research on network structure. In this study, instead of focusing on architectures, we focused on the convolution…

计算机视觉与模式识别 · 计算机科学 2019-02-12 Yunho Jeon , Junmo Kim

Modern deep convolutional networks (CNNs) are often criticized for not generalizing under distributional shifts. However, several recent breakthroughs in transfer learning suggest that these networks can cope with severe distribution shifts…

Despite recent advances in representation learning in hypercomplex (HC) space, this subject is still vastly unexplored in the context of graphs. Motivated by the complex and quaternion algebras, which have been found in several contexts to…

机器学习 · 计算机科学 2022-02-22 Tuan Le , Marco Bertolini , Frank Noé , Djork-Arné Clevert

Neural networks (NNs) whose subnetworks implement reusable functions are expected to offer numerous advantages, including compositionality through efficient recombination of functional building blocks, interpretability, preventing…

神经与进化计算 · 计算机科学 2021-03-09 Róbert Csordás , Sjoerd van Steenkiste , Jürgen Schmidhuber

In this paper, we study deep diagonal circulant neural networks, that is deep neural networks in which weight matrices are the product of diagonal and circulant ones. Besides making a theoretical analysis of their expressivity, we…

机器学习 · 计算机科学 2019-11-22 Alexandre Araujo , Benjamin Negrevergne , Yann Chevaleyre , Jamal Atif

Graph Neural Networks (GNN) can capture the geometric properties of neural representations in EEG data. Here we utilise those to study how reinforcement-based motor learning affects neural activity patterns during motor planning, leveraging…

机器学习 · 计算机科学 2024-11-01 Federico Nardi , Jinpei Han , Shlomi Haar , A. Aldo Faisal

Recent work on mode connectivity in the loss landscape of deep neural networks has demonstrated that the locus of (sub-)optimal weight vectors lies on continuous paths. In this work, we train a neural network that serves as a hypernetwork,…

机器学习 · 统计学 2019-05-09 Lior Deutsch , Erik Nijkamp , Yu Yang

Large language models perform text generation through high-dimensional internal dynamics, yet the temporal organisation of these dynamics remains poorly understood. Most interpretability approaches emphasise static representations or causal…

人工智能 · 计算机科学 2026-01-21 Hassan Ugail , Newton Howard

Recent NLP studies reveal that substantial linguistic information can be attributed to single neurons, i.e., individual dimensions of the representation vectors. We hypothesize that modeling strong interactions among neurons helps to better…

计算与语言 · 计算机科学 2019-11-25 Jian Li , Xing Wang , Baosong Yang , Shuming Shi , Michael R. Lyu , Zhaopeng Tu

Rigid body interactions are fundamental to numerous scientific disciplines, but remain challenging to simulate due to their abrupt nonlinear nature and sensitivity to complex, often unknown environmental factors. These challenges call for…

机器学习 · 计算机科学 2025-07-28 Amaury Wei , Olga Fink