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Out-of-distribution (OOD) detection is critical when deploying machine learning models in the real world. Outlier exposure methods, which incorporate auxiliary outlier data in the training process, can drastically improve OOD detection…

机器学习 · 计算机科学 2025-01-09 Claus Hofmann , Simon Schmid , Bernhard Lehner , Daniel Klotz , Sepp Hochreiter

Sequential learning involves learning tasks in a sequence, and proves challenging for most neural networks. Biological neural networks regularly conquer the sequential learning challenge and are even capable of transferring knowledge both…

神经与进化计算 · 计算机科学 2025-03-06 Hayden McAlister , Anthony Robins , Lech Szymanski

Various work has suggested that the memorability of an image is consistent across people, and thus can be treated as an intrinsic property of an image. Using computer vision models, we can make specific predictions about what people will…

计算机视觉与模式识别 · 计算机科学 2022-01-11 Coen D. Needell , Wilma A. Bainbridge

We describe a hybrid analog-digital computing approach to solve important combinatorial optimization problems that leverages memristors (two-terminal nonvolatile memories). While previous memristor accelerators have had to minimize analog…

Machine unlearning aims to remove the influence of specific training data from a learned model without full retraining. While recent work has begun to explore unlearning in quantum machine learning, existing approaches largely rely on…

机器学习 · 计算机科学 2026-02-10 Nausherwan Malik , Zubair Khalid , Muhammad Faryad

Constructing a quantum memory node with the ability of long-distance atom-photon distribution is the essential task for future quantum networks, enabling distributed quantum computing, quantum cryptography and remote sensing. Here we report…

The use of machine learning is becoming increasingly common in computational materials science. To build effective models of the chemistry of materials, useful machine-based representations of atoms and their compounds are required. We…

材料科学 · 物理学 2021-08-02 Luis M. Antunes , Ricardo Grau-Crespo , Keith T. Butler

In this work, we use the artificial neural network (ANN) method to study and predict the distribution of strong coupling constants by fitting the existing data. Our approach takes advantage of the ability of ANN to learn complex nonlinear…

高能物理 - 唯象学 · 物理学 2023-06-12 Xiao-Yun Wang , Chen Dong , Quanjin Wang

Quantum computational chemistry holds great promise for simulating molecular systems more efficiently than classical methods by leveraging quantum bits to represent molecular wavefunctions. However, current implementations face significant…

量子物理 · 物理学 2025-09-10 Weitang Li , Shi-Xin Zhang , Zirui Sheng , Cunxi Gong , Jianpeng Chen , Zhigang Shuai

A deep neural network (DNN) has been developed to generate the distributions of nuclear charge density, utilizing the training data from the relativistic density functional theory and incorporating available experimental charge radii of…

核理论 · 物理学 2024-07-09 Tian Shuai Shang , Hui Hui Xie , Jian Li , Haozhao Liang

Breast cancer diagnosis through thermographic image analysis remains a critical challenge in medical AI, with classical deep learning approaches facing limitations in complex thermal pattern classification tasks. This paper presents a novel…

Accurate amine property prediction is essential for optimizing CO2 capture efficiency in post-combustion processes. Quantum machine learning (QML) can enhance predictive modeling by leveraging superposition, entanglement, and interference…

量子物理 · 物理学 2025-06-24 Hyein Cho , Jeonghoon Kim , Hocheol Lim

We present an effective application of quantum machine learning in the field of healthcare. The study here emphasizes on a classification problem of a histopathological cancer detection using quantum transfer learning. Rather than using…

量子物理 · 物理学 2023-02-10 Reek Majumdar , Biswaraj Baral , Bhavika Bhalgamiya , Taposh Dutta Roy

Associative memories in the brain receive and store patterns of activity registered by the sensory neurons, and are able to retrieve them when necessary. Due to their importance in human intelligence, computational models of associative…

Ensemble learning is a widespread technique to improve the prediction performance of neural networks. However, it comes at the price of increased memory and inference time. In this work we propose a novel model fusion technique called…

机器学习 · 计算机科学 2025-02-12 Muhammed Öz , Nicholas Kiefer , Charlotte Debus , Jasmin Hörter , Achim Streit , Markus Götz

Our work combines aspects of three promising paradigms in machine learning, namely, attention mechanism, energy-based models, and associative memory. Attention is the power-house driving modern deep learning successes, but it lacks clear…

Accurate molecular force fields are of paramount importance for the efficient implementation of molecular dynamics techniques at large scales. In the last decade, machine learning methods have demonstrated impressive performances in…

量子物理 · 物理学 2022-07-22 Oriel Kiss , Francesco Tacchino , Sofia Vallecorsa , Ivano Tavernelli

Magnetic resonance image reconstruction starting from undersampled k-space data requires the recovery of many potential nonlinear features, which is very difficult for algorithms to recover these features. In recent years, the development…

图像与视频处理 · 电气工程与系统科学 2024-10-15 Shuo Zhou , Yihang Zhou , Congcong Liu , Yanjie Zhu , Hairong Zheng , Dong Liang , Haifeng Wang

This paper proposes a deep neural network approach for predicting multiphase flow in heterogeneous domains with high computational efficiency. The deep neural network model is able to handle permeability heterogeneity in high dimensional…

机器学习 · 计算机科学 2021-03-15 Gege Wen , Meng Tang , Sally M. Benson

We characterize the pre-softmax attention matrix $\mathbf{QK^\top}$ in transformers as an associative memory matrix encoding pairwise associations between input features. By decomposing this matrix into its symmetric and skew-symmetric…

机器学习 · 计算机科学 2026-05-28 Hyunmin Cho , Woo Kyoung Han , Kyong Hwan Jin
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