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Deep learning for predicting the electronic-structure Hamiltonian of quantum systems necessitates satisfying the covariance laws, among which achieving SO(3)-equivariance without sacrificing the non-linear expressive capability of networks…

Computational Physics · Physics 2024-06-25 Shi Yin , Xinyang Pan , Xudong Zhu , Tianyu Gao , Haochong Zhang , Feng Wu , Lixin He

Incorporating inductive bias by embedding geometric entities (such as rays) as input has proven successful in multi-view learning. However, the methods adopting this technique typically lack equivariance, which is crucial for effective 3D…

Computer Vision and Pattern Recognition · Computer Science 2024-11-13 Yinshuang Xu , Dian Chen , Katherine Liu , Sergey Zakharov , Rares Ambrus , Kostas Daniilidis , Vitor Guizilini

We introduce $\pi^3$, a feed-forward neural network that offers a novel approach to visual geometry reconstruction, breaking the reliance on a conventional fixed reference view. Previous methods often anchor their reconstructions to a…

Computer Vision and Pattern Recognition · Computer Science 2026-03-10 Yifan Wang , Jianjun Zhou , Haoyi Zhu , Wenzheng Chang , Yang Zhou , Zizun Li , Junyi Chen , Jiangmiao Pang , Chunhua Shen , Tong He

The crucial role played by the underlying symmetries of high energy physics and lattice field theories calls for the implementation of such symmetries in the neural network architectures that are applied to the physical system under…

High Energy Physics - Lattice · Physics 2022-02-16 Srinath Bulusu , Matteo Favoni , Andreas Ipp , David I. Müller , Daniel Schuh

One of the most fundamental problems in machine learning is to compare examples: Given a pair of objects we want to return a value which indicates degree of (dis)similarity. Similarity is often task specific, and pre-defined distances can…

Machine Learning · Statistics 2022-08-31 Shubhendu Trivedi

Protein complexes are macromolecules essential to the functioning and well-being of all living organisms. As the structure of a protein complex, in particular its region of interaction between multiple protein subunits (i.e., chains), has a…

Machine Learning · Computer Science 2022-05-26 Alex Morehead , Xiao Chen , Tianqi Wu , Jian Liu , Jianlin Cheng

We demonstrate an object tracking method for 3D images with fixed computational cost and state-of-the-art performance. Previous methods predicted transformation parameters from convolutional layers. We instead propose an architecture that…

Computer Vision and Pattern Recognition · Computer Science 2021-09-28 Daniel Moyer , Esra Abaci Turk , P Ellen Grant , William M. Wells , Polina Golland

We present a simple non-generative approach to deep representation learning that seeks equivariant deep embedding through simple objectives. In contrast to existing equivariant networks, our transformation coding approach does not constrain…

Machine Learning · Computer Science 2022-02-23 Mehran Shakerinava , Arnab Kumar Mondal , Siamak Ravanbakhsh

Geometric deep learning refers to the scenario in which the symmetries of a dataset are used to constrain the parameter space of a neural network and thus, improve their trainability and generalization. Recently this idea has been…

Quantum Physics · Physics 2024-11-19 Sreetama Das , Stefano Martina , Filippo Caruso

This paper proposes a set of rules to revise various neural networks for 3D point cloud processing to rotation-equivariant quaternion neural networks (REQNNs). We find that when a neural network uses quaternion features under certain…

Computer Vision and Pattern Recognition · Computer Science 2020-10-13 Wen Shen , Binbin Zhang , Shikun Huang , Zhihua Wei , Quanshi Zhang

The Python robotics ecosystem faces a challenge: while many libraries exist for rigid body transformations, few are both lightweight and mathematically strict. This paper introduces SE3Kit, a lightweight Python library efficient operations…

Robotics · Computer Science 2026-05-22 Daniyal Maroufi , Omid Rezayof , Farshid Alambeigi

From early image processing to modern computational imaging, successful models and algorithms have relied on a fundamental property of natural signals: symmetry. Here symmetry refers to the invariance property of signal sets to…

Signal Processing · Electrical Eng. & Systems 2022-09-07 Dongdong Chen , Mike Davies , Matthias J. Ehrhardt , Carola-Bibiane Schönlieb , Ferdia Sherry , Julián Tachella

We survey the mathematical foundations of geometric deep learning, focusing on group equivariant and gauge equivariant neural networks. We develop gauge equivariant convolutional neural networks on arbitrary manifolds $\mathcal{M}$ using…

Partial point cloud registration is a challenging problem in robotics, especially when the robot undergoes a large transformation, causing a significant initial pose error and a low overlap between measurements. This work proposes…

Robotics · Computer Science 2024-07-25 Chien Erh Lin , Minghan Zhu , Maani Ghaffari

We present a three-dimensional graph convolutional network (3DGCN), which predicts molecular properties and biochemical activities, based on 3D molecular graph. In the 3DGCN, graph convolution is unified with learning operations on the…

Machine Learning · Computer Science 2019-08-08 Hyeoncheol Cho , Insung S. Choi

Equivariant Graph neural Networks (EGNs) are powerful in characterizing the dynamics of multi-body physical systems. Existing EGNs conduct flat message passing, which, yet, is unable to capture the spatial/dynamical hierarchy for complex…

Machine Learning · Computer Science 2022-10-18 Jiaqi Han , Wenbing Huang , Tingyang Xu , Yu Rong

We address the problem of 3D rotation equivariance in convolutional neural networks. 3D rotations have been a challenging nuisance in 3D classification tasks requiring higher capacity and extended data augmentation in order to tackle it. We…

Computer Vision and Pattern Recognition · Computer Science 2018-10-01 Carlos Esteves , Christine Allen-Blanchette , Ameesh Makadia , Kostas Daniilidis

Rotation-invariance is a desired property of machine-learning models for medical image analysis and in particular for computational pathology applications. We propose a framework to encode the geometric structure of the special Euclidean…

Computer Vision and Pattern Recognition · Computer Science 2020-02-21 Maxime W. Lafarge , Erik J. Bekkers , Josien P. W. Pluim , Remco Duits , Mitko Veta

6D pose estimation of rigid objects from RGB-D images is crucial for object grasping and manipulation in robotics. Although RGB channels and the depth (D) channel are often complementary, providing respectively the appearance and geometry…

Computer Vision and Pattern Recognition · Computer Science 2022-08-18 Haoran Pan , Jun Zhou , Yuanpeng Liu , Xuequan Lu , Weiming Wang , Xuefeng Yan , Mingqiang Wei

Shape assembly aims to reassemble parts (or fragments) into a complete object, which is a common task in our daily life. Different from the semantic part assembly (e.g., assembling a chair's semantic parts like legs into a whole chair),…

Computer Vision and Pattern Recognition · Computer Science 2023-12-19 Ruihai Wu , Chenrui Tie , Yushi Du , Yan Zhao , Hao Dong