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Incorporating symmetries can lead to highly data-efficient and generalizable models by defining equivalence classes of data samples related by transformations. However, characterizing how transformations act on input data is often…

Machine Learning · Computer Science 2022-07-04 Jung Yeon Park , Ondrej Biza , Linfeng Zhao , Jan Willem van de Meent , Robin Walters

Molecular sciences address a wide range of problems involving molecules of different types and sizes and their complexes. Recently, geometric deep learning, especially Graph Neural Networks, has shown promising performance in molecular…

Machine Learning · Computer Science 2023-11-21 Shuo Zhang , Yang Liu , Lei Xie

Many recent efforts have been devoted to designing sophisticated deep learning structures, obtaining revolutionary results on benchmark datasets. The success of these deep learning methods mostly relies on an enormous volume of labeled…

Computer Vision and Pattern Recognition · Computer Science 2015-10-20 Jiaji Huang , Qiang Qiu , Robert Calderbank , Guillermo Sapiro

Many successful deep learning architectures are equivariant to certain transformations in order to conserve parameters and improve generalization: most famously, convolution layers are equivariant to shifts of the input. This approach only…

Machine Learning · Computer Science 2021-03-31 Allan Zhou , Tom Knowles , Chelsea Finn

Protein engineering is experiencing a paradigmatic shift through the integration of geometric deep learning into computational design workflows. While traditional strategies, such as rational design and directed evolution, have enabled…

Malware detection is an interesting and valuable domain to work in because it has significant real-world impact and unique machine-learning challenges. We investigate existing long-range techniques and benchmarks and find that they're not…

Cryptography and Security · Computer Science 2024-03-28 Mohammad Mahmudul Alam , Edward Raff , Stella Biderman , Tim Oates , James Holt

Quantum Neural Networks (QNNs) are suggested as one of the quantum algorithms which can be efficiently simulated with a low depth on near-term quantum hardware in the presence of noises. However, their performance highly relies on choosing…

Quantum Physics · Physics 2024-03-14 Su Yeon Chang , Michele Grossi , Bertrand Le Saux , Sofia Vallecorsa

Geometric 3D scene classification is a very challenging task. Current methodologies extract the geometric information using only a depth channel provided by an RGB-D sensor. These kinds of methodologies introduce possible errors due to…

Computer Vision and Pattern Recognition · Computer Science 2020-03-10 Albert Mosella-Montoro , Javier Ruiz-Hidalgo

Time, cost, and energy efficiency are critical considerations in Deep-Learning (DL), particularly when processing long texts. Transformers, which represent the current state of the art, exhibit quadratic computational complexity relative to…

Computation and Language · Computer Science 2025-07-11 Fardin Rastakhiz

Digital histology images are amenable to the application of convolutional neural network (CNN) for analysis due to the sheer size of pixel data present in them. CNNs are generally used for representation learning from small image patches…

Image and Video Processing · Electrical Eng. & Systems 2019-07-24 Muhammad Shaban , Ruqayya Awan , Muhammad Moazam Fraz , Ayesha Azam , David Snead , Nasir M. Rajpoot

Geometric Graph Neural Networks (GNNs) and Transformers have become state-of-the-art for learning from 3D protein structures. However, their reliance on message passing prevents them from capturing the hierarchical interactions that govern…

Machine Learning · Computer Science 2025-12-09 Chang Liu , Vivian Li , Linus Leong , Vladimir Radenkovic , Pietro Liò , Chaitanya K. Joshi

This paper develops a novel mathematical framework for collaborative learning by means of geometrically inspired kernel machines which includes statements on the bounds of generalisation and approximation errors, and sample complexity. For…

With the advent of group equivariant convolutions in deep networks literature, spherical CNNs with $\mathsf{SO}(3)$-equivariant layers have been developed to cope with data that are samples of signals on the sphere $S^2$. One can implicitly…

Computer Vision and Pattern Recognition · Computer Science 2023-05-29 Gianfranco Cortes , Yue Yu , Robin Chen , Melissa Armstrong , David Vaillancourt , Baba C. Vemuri

Current end-to-end machine reading and question answering (Q\&A) models are primarily based on recurrent neural networks (RNNs) with attention. Despite their success, these models are often slow for both training and inference due to the…

Computation and Language · Computer Science 2018-04-26 Adams Wei Yu , David Dohan , Minh-Thang Luong , Rui Zhao , Kai Chen , Mohammad Norouzi , Quoc V. Le

We introduce convolutional multi-hybrid architectures, with a design grounded on two simple observations. First, operators in hybrid models can be tailored to token manipulation tasks such as in-context recall, multi-token recall, and…

Medical image segmentation has seen significant improvements with transformer models, which excel in grasping far-reaching contexts and global contextual information. However, the increasing computational demands of these models,…

Computer Vision and Pattern Recognition · Computer Science 2023-09-04 Reza Azad , Leon Niggemeier , Michael Huttemann , Amirhossein Kazerouni , Ehsan Khodapanah Aghdam , Yury Velichko , Ulas Bagci , Dorit Merhof

Manipulating objects with varying geometries and deformable objects is a major challenge in robotics. Tasks such as insertion with different objects or cloth hanging require precise control and effective modelling of complex dynamics. In…

Machine Learning · Computer Science 2025-04-17 Tai Hoang , Huy Le , Philipp Becker , Vien Anh Ngo , Gerhard Neumann

Equivariance is a nice property to have as it produces much more parameter efficient neural architectures and preserves the structure of the input through the feature mapping. Even though some combinations of transformations might never…

Computer Vision and Pattern Recognition · Computer Science 2020-02-11 David W. Romero , Mark Hoogendoorn

By conceiving physical systems as 3D many-body point clouds, geometric graph neural networks (GNNs), such as SE(3)/E(3) equivalent GNNs, have showcased promising performance. In particular, their effective message-passing mechanics make…

Machine Learning · Computer Science 2024-01-30 Weitao Du , Shengchao Liu , Xuecang Zhang

We investigate in-context learning (ICL) through a meticulous experimental framework that systematically varies task complexity and model architecture. Extending beyond the linear regression baseline, we introduce Gaussian kernel regression…

Machine Learning · Computer Science 2025-05-13 Binwen Liu , Peiyu Xu , Quan Yuan , Yihong Chen
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