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Motivation: Despite its great success in various physical modeling, differential geometry (DG) has rarely been devised as a versatile tool for analyzing large, diverse and complex molecular and biomolecular datasets due to the limited…

Quantitative Methods · Quantitative Biology 2018-06-12 Duc Duy Nguyen , Guo-Wei Wei

We propose a graph semi-supervised learning framework for classification tasks on data manifolds. Motivated by the manifold hypothesis, we model data as points sampled from a low-dimensional manifold $\mathcal{M} \subset \mathbb{R}^F$. The…

Machine Learning · Computer Science 2025-11-03 Caio F. Deberaldini Netto , Zhiyang Wang , Luana Ruiz

In this paper, we consider data acquired by multimodal sensors capturing complementary aspects and features of a measured phenomenon. We focus on a scenario in which the measurements share mutual sources of variability but might also be…

Machine Learning · Computer Science 2022-02-03 Ori Katz , Roy R. Lederman , Ronen Talmon

Graph kernels have been successfully applied to many graph classification problems. Typically, a kernel is first designed, and then an SVM classifier is trained based on the features defined implicitly by this kernel. This two-stage…

Point clouds are sets of points in two or three dimensions. Most kernel methods for learning on sets of points have not yet dealt with the specific geometrical invariances and practical constraints associated with point clouds in computer…

Machine Learning · Computer Science 2007-12-21 Francis Bach

We propose a nonlinear manifold learning technique based on deep convolutional autoencoders that is appropriate for model order reduction of physical systems in complex geometries. Convolutional neural networks have proven to be highly…

Computational Physics · Physics 2021-07-19 John Tencer , Kevin Potter

Time series forecasting is an extensively studied subject in statistics, economics, and computer science. Exploration of the correlation and causation among the variables in a multivariate time series shows promise in enhancing the…

Machine Learning · Computer Science 2021-04-22 Chao Shang , Jie Chen , Jinbo Bi

Despite progress in the rapidly developing field of geometric deep learning, performing statistical analysis on geometric data--where each observation is a shape such as a curve, graph, or surface--remains challenging due to the…

Computer Vision and Pattern Recognition · Computer Science 2025-08-12 Emmanuel Hartman , Nicolas Charon

Drawing motivation from the manifold hypothesis, which posits that most high-dimensional data lies on or near low-dimensional manifolds, we apply manifold learning to the space of neural networks. We learn manifolds where datapoints are…

Machine learning (ML) and deep learning (DL) techniques have gained significant attention as reduced order models (ROMs) to computationally expensive structural analysis methods, such as finite element analysis (FEA). Graph neural network…

Machine Learning · Computer Science 2023-09-25 Yuecheng Cai , Jasmin Jelovica

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…

This paper provides a new similarity detection algorithm. Given an input set of multi-dimensional data points, where each data point is assumed to be multi-dimensional, and an additional reference data point for similarity finding, the…

Artificial Intelligence · Computer Science 2017-07-12 Yariv Aizenbud , Amir Averbuch , Gil Shabat , Guy Ziv

Kernel methods play a critical role in many machine learning algorithms. They are useful in manifold learning, classification, clustering and other data analysis tasks. Setting the kernel's scale parameter, also referred to as the kernel's…

Machine Learning · Computer Science 2019-06-06 Ofir Lindenbaum , Moshe Salhov , Arie Yeredor , Amir Averbuch

Diffusion Maps framework is a kernel based method for manifold learning and data analysis that defines diffusion similarities by imposing a Markovian process on the given dataset. Analysis by this process uncovers the intrinsic geometric…

Machine Learning · Statistics 2015-11-20 Moshe Salhov , Amit Bermanis , Guy Wolf , Amir Averbuch

Graph kernels are kernel methods measuring graph similarity and serve as a standard tool for graph classification. However, the use of kernel methods for node classification, which is a related problem to graph representation learning, is…

Machine Learning · Computer Science 2019-10-08 Yu Tian , Long Zhao , Xi Peng , Dimitris N. Metaxas

Many of today's most interesting questions involve understanding and interpreting complex relationships within graph-based structures. For instance, in materials science, predicting material properties often relies on analyzing the…

Emerging Technologies · Computer Science 2024-05-08 Derek Gobin , Shay Snyder , Guojing Cong , Shruti R. Kulkarni , Catherine Schuman , Maryam Parsa

We study the multiple manifold problem, a binary classification task modeled on applications in machine vision, in which a deep fully-connected neural network is trained to separate two low-dimensional submanifolds of the unit sphere. We…

Machine Learning · Statistics 2021-05-07 Sam Buchanan , Dar Gilboa , John Wright

In this work, we develop new generalization bounds for neural networks trained on data supported on Riemannian manifolds. Existing generalization theories often rely on complexity measures derived from Euclidean geometry, which fail to…

Machine Learning · Computer Science 2025-07-08 Krisanu Sarkar

The inductive bias of a graph neural network (GNN) is largely encoded in its specified graph. Latent graph inference relies on latent geometric representations to dynamically rewire or infer a GNN's graph to maximize the GNN's predictive…

Machine Learning · Computer Science 2025-03-11 Haitz Sáez de Ocáriz Borde , Anastasis Kratsios

A fundamental task in data exploration is to extract simplified low dimensional representations that capture intrinsic geometry in data, especially for faithfully visualizing data in two or three dimensions. Common approaches to this task…

Machine Learning · Statistics 2021-07-30 Andrés F. Duque , Sacha Morin , Guy Wolf , Kevin R. Moon
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