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Materials informatics (MI), emerging from the integration of materials science and data science, is expected to significantly accelerate material development and discovery. The data used in MI are derived from both computational and…

Materials Science · Physics 2025-04-09 Yusuke Hashimoto , Xue Jia , Hao Li , Takaaki Tomai

Solidification governs the microstructure and, therefore, the mechanical response of metal components, yet the atomistic details of nucleation and defect formation are often difficult to determine experimentally. Molecular dynamics can…

Computational Physics · Physics 2026-03-26 Ian Störmer , Julija Zavadlav

Existing knowledge distillation (KD) methods have demonstrated their ability in achieving student network performance on par with their teachers. However, the knowledge gap between the teacher and student remains significant and may hinder…

Computer Vision and Pattern Recognition · Computer Science 2024-12-17 Shuoxi Zhang , Zijian Song , Kun He

Dataset Distillation (DD), a newly emerging field, aims at generating much smaller but efficient synthetic training datasets from large ones. Existing DD methods based on gradient matching achieve leading performance; however, they are…

Machine Learning · Computer Science 2023-04-18 Lei Zhang , Jie Zhang , Bowen Lei , Subhabrata Mukherjee , Xiang Pan , Bo Zhao , Caiwen Ding , Yao Li , Dongkuan Xu

Diffusion-based models decompose sampling into many small Gaussian denoising steps -- an assumption that breaks down when generation is compressed to a few coarse transitions. Existing few-step methods address this through distillation,…

Computer Vision and Pattern Recognition · Computer Science 2026-05-14 Jiatao Gu , Tianrong Chen , Ying Shen , David Berthelot , Shuangfei Zhai , Josh Susskind

Deep Neural Networks have achieved huge success at a wide spectrum of applications from language modeling, computer vision to speech recognition. However, nowadays, good performance alone is not sufficient to satisfy the needs of practical…

Machine Learning · Computer Science 2018-12-31 Xuan Liu , Xiaoguang Wang , Stan Matwin

Deep learning algorithms have been shown to perform extremely well on many classical machine learning problems. However, recent studies have shown that deep learning, like other machine learning techniques, is vulnerable to adversarial…

Cryptography and Security · Computer Science 2016-03-15 Nicolas Papernot , Patrick McDaniel , Xi Wu , Somesh Jha , Ananthram Swami

Spiking Neural Networks (SNNs) exhibit exceptional energy efficiency on neuromorphic hardware due to their sparse activation patterns. However, conventional training methods based on surrogate gradients and Backpropagation Through Time…

Computer Vision and Pattern Recognition · Computer Science 2025-10-09 Xiaochen Zhao , Chengting Yu , Kairong Yu , Lei Liu , Aili Wang

Deep neural networks (DNNs) have proven to be effective models for accurate Memory Access Prediction (MAP), a critical task in mitigating memory latency through data prefetching. However, existing DNN-based MAP models suffer from the…

Machine Learning · Computer Science 2024-02-22 Neelesh Gupta , Pengmiao Zhang , Rajgopal Kannan , Viktor Prasanna

The use of machine learning interatomic potentials (MLIPs) in simulations of materials is a state-of-the-art approach, which allows achieving nearly \textit{ab initio} accuracy with orders of magnitude less computational cost.…

Materials Science · Physics 2021-10-28 R. E. Ryltsev , N. M. Chtchelkatchev

Dataset distillation (DD) has emerged as a widely adopted technique for crafting a synthetic dataset that captures the essential information of a training dataset, facilitating the training of accurate neural models. Its applications span…

Machine Learning · Computer Science 2025-02-04 Saeed Vahidian , Mingyu Wang , Jianyang Gu , Vyacheslav Kungurtsev , Wei Jiang , Yiran Chen

Recent advances in deep learning have facilitated the demand of neural models for real applications. In practice, these applications often need to be deployed with limited resources while keeping high accuracy. This paper touches the core…

Information Retrieval · Computer Science 2019-06-04 Bonggun Shin , Hao Yang , Jinho D. Choi

Materials language processing (MLP) is one of the key facilitators of materials science research, as it enables the extraction of structured information from massive materials science literature. Prior works suggested high-performance MLP…

Computation and Language · Computer Science 2023-08-21 Jaewoong Choi , Byungju Lee

Non-autoregressive machine translation (NAT) systems predict a sequence of output tokens in parallel, achieving substantial improvements in generation speed compared to autoregressive models. Existing NAT models usually rely on the…

Computation and Language · Computer Science 2021-02-24 Chunting Zhou , Graham Neubig , Jiatao Gu

Knowledge distillation in neural networks refers to compressing a large model or dataset into a smaller version of itself. We introduce Privacy Distillation, a framework that allows a text-to-image generative model to teach another model…

Recent advancements in machine learning have showcased its potential to significantly accelerate the discovery of new materials. Central to this progress is the development of rapidly computable property predictors, enabling the…

Materials Science · Physics 2024-04-16 Kohei Noda , Araki Wakiuchi , Yoshihiro Hayashi , Ryo Yoshida

The technique of distillation helps transform cumbersome neural network into compact network so that the model can be deployed on alternative hardware devices. The main advantages of distillation based approaches include simple training…

Computer Vision and Pattern Recognition · Computer Science 2020-10-27 Zi-Rui Wang , Jun Du

Deep learning based generative models such as deepfake have been able to generate amazing images and videos. However, these models may need significant transformation when applied to generate crystal materials structures in which the…

Materials Science · Physics 2021-12-15 Yong Zhao , Edirisuriya MD Siriwardane , Jianjun Hu

Deep learning techniques have achieved great success in many fields, while at the same time deep learning models are getting more complex and expensive to compute. It severely hinders the wide applications of these models. In order to…

Computation and Language · Computer Science 2021-04-20 Yongqi Li , Wenjie Li

Recommender systems now consume large-scale data and play a significant role in improving user experience. Graph Neural Networks (GNNs) have emerged as one of the most effective recommender system models because they model the rich…

Information Retrieval · Computer Science 2023-05-03 Yuening Wang , Yingxue Zhang , Antonios Valkanas , Ruiming Tang , Chen Ma , Jianye Hao , Mark Coates