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Surrogate models are used to alleviate the computational burden in engineering tasks, which require the repeated evaluation of computationally demanding models of physical systems, such as the efficient propagation of uncertainties. For…

机器学习 · 统计学 2022-09-28 Felix Schneider , Iason Papaioannou , Gerhard Müller

The past few years have witnessed growth in the computational requirements for training deep convolutional neural networks. Current approaches parallelize training onto multiple devices by applying a single parallelization strategy (e.g.,…

机器学习 · 计算机科学 2018-06-12 Zhihao Jia , Sina Lin , Charles R. Qi , Alex Aiken

Representation learning, i.e. the generation of representations useful for downstream applications, is a task of fundamental importance that underlies much of the success of deep neural networks (DNNs). Recently, robustness to adversarial…

机器学习 · 计算机科学 2022-09-16 Christian Cianfarani , Arjun Nitin Bhagoji , Vikash Sehwag , Ben Y. Zhao , Prateek Mittal , Haitao Zheng

Modern deep neural networks are highly over-parameterized compared to the data on which they are trained, yet they often generalize remarkably well. A flurry of recent work has asked: why do deep networks not overfit to their training data?…

机器学习 · 计算机科学 2023-03-24 Minyoung Huh , Hossein Mobahi , Richard Zhang , Brian Cheung , Pulkit Agrawal , Phillip Isola

Continual Learning (CL) is a field dedicated to devise algorithms able to achieve lifelong learning. Overcoming the knowledge disruption of previously acquired concepts, a drawback affecting deep learning models and that goes by the name of…

计算机视觉与模式识别 · 计算机科学 2023-01-04 Francesco Pelosin

The estimation of unknown values of parameters (or hidden variables, control variables) that characterise a physical system often relies on the comparison of measured data with synthetic data produced by some numerical simulator of the…

机器学习 · 计算机科学 2019-01-28 Xi Chen , Mike Hobson

High-performance scientific simulations, important for comprehension of complex systems, encounter computational challenges especially when exploring extensive parameter spaces. There has been an increasing interest in developing deep…

Deep neural network based recommendation systems have achieved great success as information filtering techniques in recent years. However, since model training from scratch requires sufficient data, deep learning-based recommendation…

信息检索 · 计算机科学 2022-06-10 Chunyang Wang , Yanmin Zhu , Haobing Liu , Tianzi Zang , Jiadi Yu , Feilong Tang

Ensembling a neural network is a widely recognized approach to enhance model performance, estimate uncertainty, and improve robustness in deep supervised learning. However, deep ensembles often come with high computational costs and memory…

We study how different output layer parameterizations of a deep neural network affects learning and forgetting in continual learning settings. The following three effects can cause catastrophic forgetting in the output layer: (1) weights…

机器学习 · 计算机科学 2022-08-19 Timothée Lesort , Thomas George , Irina Rish

Deep learning yields great results across many fields, from speech recognition, image classification, to translation. But for each problem, getting a deep model to work well involves research into the architecture and a long period of…

机器学习 · 计算机科学 2017-06-19 Lukasz Kaiser , Aidan N. Gomez , Noam Shazeer , Ashish Vaswani , Niki Parmar , Llion Jones , Jakob Uszkoreit

The inapplicability of amino acid covariation methods to small protein families has limited their use for structural annotation of whole genomes. Recently, deep learning has shown promise in allowing accurate residue-residue contact…

生物大分子 · 定量生物学 2019-09-10 Joe G Greener , Shaun M Kandathil , David T Jones

Deep metric learning (DML) aims to minimize empirical expected loss of the pairwise intra-/inter- class proximity violations in the embedding space. We relate DML to feasibility problem of finite chance constraints. We show that minimizer…

计算机视觉与模式识别 · 计算机科学 2023-09-08 Yeti Z. Gurbuz , Ogul Can , A. Aydin Alatan

Data-driven approaches such as deep learning can result in predictive models for material properties with exceptional accuracy and efficiency. However, in many applications, data is sparse, severely limiting their accuracy and…

机器学习 · 计算机科学 2025-10-29 Robert J Appleton , Brian C Barnes , Alejandro Strachan

The correlations between the sequence of monomers in a polymer and its three-dimensional structure is a grand challenge in polymer science and biology. The properties and functions of macromolecules depend on their 3D shape that has…

材料科学 · 物理学 2021-07-15 Ashwin A Bale , Tarak K Patra

Accurate prediction of polymer properties is essential for materials design, but remains challenging due to data scarcity, diverse polymer representations, and the lack of systematic evaluation across modelling choices. Here, we present…

软凝聚态物质 · 物理学 2026-03-17 Gaopeng Ren , Yijie Yang , Jiajun Zhou , Kim E. Jelfs

Deep learning models are used to minimize the number of polyps that goes unnoticed by the experts and to accurately segment the detected polyps during interventions. Although state-of-the-art models are proposed, it remains a challenge to…

图像与视频处理 · 电气工程与系统科学 2023-03-21 Tugberk Erol , Duygu Sarikaya

While deep learning (DL)-based methods have achieved remarkable success in continuous wireless resource allocation, efficient solutions for problems involving discrete variables remain challenging. This is primarily due to the zero-gradient…

机器学习 · 计算机科学 2026-03-23 Yikun Wang , Yang Li , Yik-Chung Wu , Rui Zhang

The rise and fall of artificial neural networks is well documented in the scientific literature of both computer science and computational chemistry. Yet almost two decades later, we are now seeing a resurgence of interest in deep learning,…

机器学习 · 统计学 2018-08-15 Garrett B. Goh , Nathan O. Hodas , Abhinav Vishnu

End-to-end training with full-depth backpropagation remains the dominant paradigm for optimizing deep neural networks, but its efficiency deteriorates as models grow deeper. Since every block must be executed and differentiated under a…

计算机视觉与模式识别 · 计算机科学 2026-05-20 Yuming Zhang , Peizhe Wang , Tianyang Han , Hengyu Shi , Junhao Su , Dongzhi Guan , Jiabin Liu , Jiaji Wang