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With model trustworthiness being crucial for sensitive real-world applications, practitioners are putting more and more focus on improving the uncertainty calibration of deep neural networks. Calibration errors are designed to quantify the…

Machine Learning · Computer Science 2024-03-14 Sebastian G. Gruber , Florian Buettner

This short course offers a new perspective on randomized algorithms for matrix computations. It explores the distinct ways in which probability can be used to design algorithms for numerical linear algebra. Each design template is…

Numerical Analysis · Mathematics 2025-09-23 Anastasia Kireeva , Joel A. Tropp

There exists a plethora of techniques for inducing structured sparsity in parametric models during the optimization process, with the final goal of resource-efficient inference. However, few methods target a specific number of…

Machine Learning · Computer Science 2018-11-26 Raphael Tang , Ashutosh Adhikari , Jimmy Lin

Predicting the structure of multi-protein complexes is a grand challenge in biochemistry, with major implications for basic science and drug discovery. Computational structure prediction methods generally leverage pre-defined structural…

Biomolecules · Quantitative Biology 2021-01-26 Stephan Eismann , Raphael J. L. Townshend , Nathaniel Thomas , Milind Jagota , Bowen Jing , Ron O. Dror

This article presents a new method to compute matrices from numerical simulations based on the ideas of sparse sampling and compressed sensing. The method is useful for problems where the determination of the entries of a matrix constitutes…

Chemical Physics · Physics 2014-10-21 Jacob N. Sanders , Xavier Andrade , Alán Aspuru-Guzik

Deep learning as a means to inferencing has proliferated thanks to its versatility and ability to approach or exceed human-level accuracy. These computational models have seemingly insatiable appetites for computational resources not only…

The use of numerical uncertainty representations allows better modeling of some aspects of human evidential reasoning. It also makes knowledge acquisition and system development, test, and modification more difficult. We propose that where…

Artificial Intelligence · Computer Science 2013-04-11 Richard A. Caruana

Inexact computing also referred to as approximate computing is a style of designing algorithms and computing systems wherein the accuracy of correctness of algorithms executing on them is deliberately traded for significant resource…

Data Structures and Algorithms · Computer Science 2023-05-31 John Augustine , Dror Fried , Krishna V. Palem , Duc-Hung Pham , Anshumali Shrivastava

The iterations of many sparse estimation algorithms are comprised of a fixed linear filter cascaded with a thresholding nonlinearity, which collectively resemble a typical neural network layer. Consequently, a lengthy sequence of algorithm…

Machine Learning · Computer Science 2016-05-11 Bo Xin , Yizhou Wang , Wen Gao , David Wipf

Over the last few years, neural networks have started penetrating safety critical systems to take decisions in robots, rockets, autonomous driving car, etc. A problem is that these critical systems often have limited computing resources.…

Software Engineering · Computer Science 2022-02-24 Hanane Benmaghnia , Matthieu Martel , Yassamine Seladji

Numerical approximate computation can solve large and complex problems fast. It has the advantage of high efficiency. However it only gives approximate results, whereas we need exact results in many fields. There is a gap between…

Algebraic Geometry · Mathematics 2015-06-26 Jingzhong Zhang , Yong Feng

Bayesian networks are probabilistic graphical models often used in big data analytics. The problem of exact structure learning is to find a network structure that is optimal under certain scoring criteria. The problem is known to be NP-hard…

Artificial Intelligence · Computer Science 2017-03-22 Subhadeep Karan , Jaroslaw Zola

CoVariance Neural Networks (VNNs) perform convolutions on the graph determined by the covariance matrix of the data, which enables expressive and stable covariance-based learning. However, covariance matrices are typically dense, fail to…

Machine Learning · Computer Science 2026-01-21 Andrea Cavallo , Samuel Rey , Antonio G. Marques , Elvin Isufi

Pseudo panels constituted with repeated cross-sections are good substitutes to true panel data. But individuals grouped in a cohort are not the same for successive periods, and it results in a measurement error and inconsistent estimators.…

Statistics Theory · Mathematics 2007-06-13 Marie Cottrell , Patrice Gaubert

Classification tasks are usually evaluated in terms of accuracy. However, accuracy is discontinuous and cannot be directly optimized using gradient ascent. Popular methods minimize cross-entropy, hinge loss, or other surrogate losses, which…

Machine Learning · Computer Science 2024-07-25 Ivan Karpukhin , Stanislav Dereka , Sergey Kolesnikov

We derive the general analytical expressions for the statistical uncertainties of cumulants up to fourth order including an efficiency correction. The analytical expressions have been tested with a toy Monte Carlo model analysis. An…

Nuclear Theory · Physics 2022-03-25 Fan Si , Yifei Zhang

Gaussian graphical models are widely used to represent correlations among entities but remain vulnerable to data corruption. In this work, we introduce a modified trimmed-inner-product algorithm to robustly estimate the covariance in an…

Machine Learning · Computer Science 2023-09-19 Tong Yao , Shreyas Sundaram

We consider the computation of the matrix logarithm by using numerical quadrature. The efficiency of numerical quadrature depends on the integrand and the choice of quadrature formula. The Gauss--Legendre quadrature has been conventionally…

Numerical Analysis · Mathematics 2019-09-09 Fuminori Tatsuoka , Tomohiro Sogabe , Yuto Miyatake , Shao-Liang Zhang

A matrix algorithm is said to be superfast (that is, runs at sublinear cost) if it involves much fewer scalars and flops than the input matrix has entries. Such algorithms have been extensively studied and widely applied in modern…

Numerical Analysis · Mathematics 2025-05-28 Soo Go , Victor Y. Pan

We describe several algorithms for matrix completion and matrix approximation when only some of its entries are known. The approximation constraint can be any whose approximated solution is known for the full matrix. For low rank…

Numerical Analysis · Mathematics 2014-07-01 Gil Shabat , Yaniv Shmueli , Amir Averbuch