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The purpose of this paper is twofold. On one side, we present a general framework for Bayesian optimization and we compare it with some related fields in active learning and Bayesian numerical analysis. On the other hand, Bayesian…

Robotics · Computer Science 2018-02-13 Ruben Martinez-Cantin

Recent advances in computer vision and machine learning suggest that a wide range of problems can be addressed more appropriately by considering non-Euclidean geometry. In this paper we explore sparse dictionary learning over the space of…

Computer Vision and Pattern Recognition · Computer Science 2013-10-21 Mehrtash Harandi , Conrad Sanderson , Chunhua Shen , Brian C. Lovell

In many fields of science, high-dimensional integration is required. Numerical methods have been developed to evaluate these complex integrals. We introduce the code i-flow, a python package that performs high-dimensional numerical…

Computational Physics · Physics 2020-08-19 Christina Gao , Joshua Isaacson , Claudius Krause

Ensembling is a well-known technique in neural machine translation (NMT) to improve system performance. Instead of a single neural net, multiple neural nets with the same topology are trained separately, and the decoder generates…

Computation and Language · Computer Science 2017-07-24 Felix Stahlberg , Bill Byrne

Topology applied to real world data using persistent homology has started to find applications within machine learning, including deep learning. We present a differentiable topology layer that computes persistent homology based on level set…

This work explores an extension of machine learning-optimized piecewise polynomial approximation by incorporating energy optimization as an additional objective. Traditional closed-form solutions enable continuity and approximation targets…

Machine Learning · Computer Science 2025-08-08 Hannes Waclawek , Stefan Huber

Machine learning problems have an intrinsic geometric structure as central objects including a neural network's weight space and the loss function associated with a particular task can be viewed as encoding the intrinsic geometry of a given…

Machine Learning · Computer Science 2021-06-08 Guruprasad Raghavan , Matt Thomson

We present an open source Python 3 library aimed at practitioners of molecular simulation, especially Monte Carlo simulation. The aims of the library are to facilitate the generation of simulation data for a wide range of problems; and to…

Libraries for supervised classification have enabled the wide-spread usage of machine learning methods. Existing libraries, such as scikit-learn, caret, and mlpack, implement techniques based on the classical empirical risk minimization…

We present a novel procedure for optimization based on the combination of efficient quantized tensor train representation and a generalized maximum matrix volume principle. We demonstrate the applicability of the new Tensor Train Optimizer…

Machine Learning · Computer Science 2022-09-29 Konstantin Sozykin , Andrei Chertkov , Roman Schutski , Anh-Huy Phan , Andrzej Cichocki , Ivan Oseledets

We propose practical deep Gaussian process models on Riemannian manifolds, similar in spirit to residual neural networks. With manifold-to-manifold hidden layers and an arbitrary last layer, they can model manifold- and scalar-valued…

Machine Learning · Statistics 2025-03-03 Kacper Wyrwal , Andreas Krause , Viacheslav Borovitskiy

We demonstrate the use of tensor networks for image classification with the TensorNetwork open source library. We explain in detail the encoding of image data into a matrix product state form, and describe how to contract the network in a…

Machine Learning · Computer Science 2019-06-17 Stavros Efthymiou , Jack Hidary , Stefan Leichenauer

This paper introduces an active learning framework for manifold Gaussian Process (GP) regression, combining manifold learning with strategic data selection to improve accuracy in high-dimensional spaces. Our method jointly optimizes a…

Machine Learning · Statistics 2026-05-12 Yuanxing Cheng , Lulu Kang , Yiwei Wang , Chun Liu

We develop algorithms for sampling from a probability distribution on a submanifold embedded in Rn. Applications are given to the evaluation of algorithms in 'Topological Statistics'; to goodness of fit tests in exponential families and to…

Statistics Theory · Mathematics 2012-07-06 Persi Diaconis , Susan Holmes , Mehrdad Shahshahani

This article presents a novel resolution to the problem of spline interpolation versus least-squares fitting on smooth Riemannian manifolds utilizing the method of gradient flows of networks. This approach represents a contribution to both…

Optimization and Control · Mathematics 2024-05-30 Chun-Chi Lin , The Dung Tran

Robotic systems are often complex and depend on the integration of a large number of software components. One important component in robotic systems provides the calculation of forward kinematics, which is required by both motion-planning…

Robotics · Computer Science 2023-03-13 Lukas Mölschl , Jakob J. Hollenstein , Justus Piater

Scientific and engineering processes deliver massive high-dimensional data sets that are generated as non-linear transformations of an initial state and few process parameters. Mapping such data to a low-dimensional manifold facilitates…

Machine Learning · Statistics 2018-08-07 Frank Schoeneman , Varun Chandola , Nils Napp , Olga Wodo , Jaroslaw Zola

Manifold learning-based encoders have been playing important roles in nonlinear dimensionality reduction (NLDR) for data exploration. However, existing methods can often fail to preserve geometric, topological and/or distributional…

Machine Learning · Computer Science 2021-05-04 Stan Z. Li , Zelin Zang , Lirong Wu

Processing-in-memory (PIM) promises to alleviate the data movement bottleneck in modern computing systems. However, current real-world PIM systems have the inherent disadvantage that their hardware is more constrained than in conventional…

Mathematical Software · Computer Science 2023-09-07 Maurus Item , Juan Gómez-Luna , Yuxin Guo , Geraldo F. Oliveira , Mohammad Sadrosadati , Onur Mutlu

A neural network with the widely-used ReLU activation has been shown to partition the sample space into many convex polytopes for prediction. However, the parameterized way a neural network and other machine learning models use to partition…

Machine Learning · Computer Science 2022-05-04 Dayang Wang , Feng-Lei Fan , Bo-Jian Hou , Hao Zhang , Zhen Jia , Boce Zhou , Rongjie Lai , Hengyong Yu , Fei Wang