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Deep learning has emerged as a promising paradigm to give access to highly accurate predictions of molecular and materials properties. A common short-coming shared by current approaches, however, is that neural networks only give point…

Computational Physics · Physics 2023-05-10 Albert Zhu , Simon Batzner , Albert Musaelian , Boris Kozinsky

Quantifying uncertainty in neural networks is a highly relevant problem which is essential to many applications. The two predominant paradigms to tackle this task are Bayesian neural networks (BNNs) and deep ensembles. Despite some…

Machine Learning · Computer Science 2025-01-31 Gabriel Loaiza-Ganem , Valentin Villecroze , Yixin Wang

In this paper, we propose a novel ensembling technique for deep neural networks, which is able to drastically reduce the required memory compared to alternative approaches. In particular, we propose to extract multiple sub-networks from a…

Machine Learning · Computer Science 2022-10-07 Jary Pomponi , Simone Scardapane , Aurelio Uncini

Deep neural networks are widely used for nonlinear function approximation with applications ranging from computer vision to control. Although these networks involve the composition of simple arithmetic operations, it can be very challenging…

Machine Learning · Computer Science 2020-12-02 Changliu Liu , Tomer Arnon , Christopher Lazarus , Christopher Strong , Clark Barrett , Mykel J. Kochenderfer

Overfitting is one of the most critical challenges in deep neural networks, and there are various types of regularization methods to improve generalization performance. Injecting noises to hidden units during training, e.g., dropout, is…

Machine Learning · Computer Science 2017-11-10 Hyeonwoo Noh , Tackgeun You , Jonghwan Mun , Bohyung Han

We introduce a new procedure for training of artificial neural networks by using the approximation of an objective function by arithmetic mean of an ensemble of selected randomly generated neural networks, and apply this procedure to the…

Neural and Evolutionary Computing · Computer Science 2012-02-21 S. V. Kozyrev

A deep neural network model is a powerful framework for learning representations. Usually, it is used to learn the relation $x \to y$ by exploiting the regularities in the input $x$. In structured output prediction problems, $y$ is…

Machine Learning · Computer Science 2017-10-31 Soufiane Belharbi , Romain Hérault , Clément Chatelain , Sébastien Adam

Deep Neural Networks (DNNs) have become increasingly popular in computer vision, natural language processing, and other areas. However, training and fine-tuning a deep learning model is computationally intensive and time-consuming. We…

Machine Learning · Computer Science 2018-07-04 Jiayi Liu , Samarth Tripathi , Unmesh Kurup , Mohak Shah

Deep ensembles can be considered as the current state-of-the-art for uncertainty quantification in deep learning. While the approach was originally proposed as a non-Bayesian technique, arguments supporting its Bayesian footing have been…

Machine Learning · Computer Science 2021-11-19 Lara Hoffmann , Clemens Elster

Neural networks have attracted a lot of attention due to its success in applications such as natural language processing and computer vision. For large scale data, due to the tremendous number of parameters in neural networks, overfitting…

Machine Learning · Statistics 2022-07-05 Xiaoxi Shen , Jinghang Lin

Despite the highest classification accuracy in wide varieties of application areas, artificial neural network has one disadvantage. The way this Network comes to a decision is not easily comprehensible. The lack of explanation ability…

Computer Vision and Pattern Recognition · Computer Science 2016-10-18 Tameru Hailesilassie

Learning deep representations to solve complex machine learning tasks has become the prominent trend in the past few years. Indeed, Deep Neural Networks are now the golden standard in domains as various as computer vision, natural language…

Machine Learning · Computer Science 2020-12-04 Vincent Gripon , Carlos Lassance , Ghouthi Boukli Hacene

Deep neural networks have become the method of choice for solving many classification tasks, largely because they can fit very complex functions defined over raw data. The downside of such powerful learners is the danger of overfit. In this…

Machine Learning · Computer Science 2023-12-29 Uri Stern , Daniel Shwartz , Daphna Weinshall

Despite apparent human-level performances of deep neural networks (DNN), they behave fundamentally differently from humans. They easily change predictions when small corruptions such as blur and noise are applied on the input (lack of…

Computer Vision and Pattern Recognition · Computer Science 2020-03-10 Sanghyuk Chun , Seong Joon Oh , Sangdoo Yun , Dongyoon Han , Junsuk Choe , Youngjoon Yoo

Underlying the use of statistical approaches for a wide range of applications is the assumption that the probabilities obtained from a statistical model are representative of the "true" probability that event, or outcome, will occur.…

Machine Learning · Computer Science 2021-01-15 Xixin Wu , Mark Gales

Classical problems in computational physics such as data-driven forecasting and signal reconstruction from sparse sensors have recently seen an explosion in deep neural network (DNN) based algorithmic approaches. However, most DNN models do…

Machine Learning · Computer Science 2023-02-21 Romit Maulik , Romain Egele , Krishnan Raghavan , Prasanna Balaprakash

Deep learning has become the state of the art approach in many machine learning problems such as classification. It has recently been shown that deep learning is highly vulnerable to adversarial perturbations. Taking the camera systems of…

Machine Learning · Statistics 2018-02-09 Thilo Strauss , Markus Hanselmann , Andrej Junginger , Holger Ulmer

Deep neural networks have seen enormous success in various real-world applications. Beyond their predictions as point estimates, increasing attention has been focused on quantifying the uncertainty of their predictions. In this review, we…

Machine Learning · Computer Science 2023-02-06 Chengyu Dong

In many contexts, simpler models are preferable to more complex models and the control of this model complexity is the goal for many methods in machine learning such as regularization, hyperparameter tuning and architecture design. In deep…

Machine Learning · Computer Science 2022-12-27 Benoit Dherin , Michael Munn , Mihaela Rosca , David G. T. Barrett

Convolutional Neural Networks have achieved state-of-the-art performance on a wide range of tasks. Most benchmarks are led by ensembles of these powerful learners, but ensembling is typically treated as a post-hoc procedure implemented by…

Computer Vision and Pattern Recognition · Computer Science 2015-11-20 Stefan Lee , Senthil Purushwalkam , Michael Cogswell , David Crandall , Dhruv Batra