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With higher-order neighborhood information of graph network, the accuracy of graph representation learning classification can be significantly improved. However, the current higher order graph convolutional network has a large number of…

Machine Learning · Computer Science 2019-08-05 FangYuan Lei , Xun Liu , QingYun Dai , Bingo Wing-Kuen Ling , Huimin Zhao , Yan Liu

The predictive accuracy of Machine Learning (ML) models of molecular properties depends on the choice of the molecular representation. Based on the postulates of quantum mechanics, we introduce a hierarchy of representations which meet…

Chemical Physics · Physics 2016-11-23 Bing Huang , O. Anatole von Lilienfeld

Model merging combines knowledge from separately fine-tuned models, yet the factors driving its success remain poorly understood. While recent work treats mergeability as an intrinsic property of the models, we show with an…

Machine Learning · Computer Science 2026-05-27 Luca Zhou , Bo Zhao , Rose Yu , Emanuele Rodolà

Model agnostic meta-learning (MAML) is a popular state-of-the-art meta-learning algorithm that provides good weight initialization of a model given a variety of learning tasks. The model initialized by provided weight can be fine-tuned to…

Machine Learning · Computer Science 2021-06-11 Thanh Nguyen , Tung Luu , Trung Pham , Sanzhar Rakhimkul , Chang D. Yoo

Model merging provides a scalable alternative to multi-task training by combining specialized finetuned models through parameter arithmetic, enabling efficient deployment without the need for joint training or access to all task data. While…

Machine Learning · Computer Science 2025-10-21 Yifei He , Siqi Zeng , Yuzheng Hu , Rui Yang , Tong Zhang , Han Zhao

Cooperation in multi-agent learning (MAL) is a topic at the intersection of numerous disciplines, including game theory, economics, social sciences, and evolutionary biology. Research in this area aims to understand both how agents can…

Multiagent Systems · Computer Science 2023-12-11 Yali Du , Joel Z. Leibo , Usman Islam , Richard Willis , Peter Sunehag

A key ingredient for semi-analytic models (SAMs) of galaxy formation is the mass assembly history of haloes, encoded in a tree structure. The most commonly used method to construct halo merger histories is based on the outcomes of…

Astrophysics of Galaxies · Physics 2022-06-28 Sandra Robles , Jonathan S. Gómez , Adín Ramírez Rivera , Nelson D. Padilla , Diego Dujovne

Mixture autoregressive (MAR) models provide a flexible way to model time series with predictive distributions which depend on the recent history of the process and are able to accommodate asymmetry and multimodality. Bayesian inference for…

Methodology · Statistics 2020-06-22 Davide Ravagli , Georgi N. Boshnakov

Training Large Language Models (LLMs) from scratch requires immense computational resources, making it prohibitively expensive. Model scaling-up offers a promising solution by leveraging the parameters of smaller models to create larger…

Machine Learning · Computer Science 2025-02-20 Yifei Yang , Zouying Cao , Xinbei Ma , Yao Yao , Libo Qin , Zhi Chen , Hai Zhao

Recent advances in large language models have led to numerous task-specialized fine-tuned variants, creating a need for efficient model merging techniques that preserve specialized capabilities while avoiding costly retraining. While…

Computation and Language · Computer Science 2025-02-20 Shuqi Liu , Han Wu , Bowei He , Xiongwei Han , Mingxuan Yuan , Linqi Song

Recent work has shown the promise of creating generalist, transformer-based, models for language, vision, and sequential decision-making problems. To create such models, we generally require centralized training objectives, data, and…

Machine Learning · Computer Science 2023-09-26 Daniel Lawson , Ahmed H. Qureshi

Choosing a suitable deep learning architecture for multimodal data fusion is a challenging task, as it requires the effective integration and processing of diverse data types, each with distinct structures and characteristics. In this…

Machine Learning · Computer Science 2025-01-22 Abdelmadjid Chergui , Grigor Bezirganyan , Sana Sellami , Laure Berti-Équille , Sébastien Fournier

Distributed machine learning (DML) over time-varying networks can be an enabler for emerging decentralized ML applications such as autonomous driving and drone fleeting. However, the commonly used weighted arithmetic mean model aggregation…

Machine Learning · Computer Science 2022-02-22 Haizhou Du , Ryan Yang , Yijian Chen , Qiao Xiang , Andre Wibisono , Wei Huang

Link prediction in multilayer networks is a key challenge in applications such as recommendation systems and protein-protein interaction prediction. While many techniques have been developed, most rely on assumptions about shared structures…

Machine Learning · Statistics 2025-06-17 Yongqin Qiu , Xinyu Zhang

Trained ML models are commonly embedded in optimization problems. In many cases, this leads to large-scale NLPs that are difficult to solve to global optimality. While ML models frequently lead to large problems, they also exhibit…

Optimization and Control · Mathematics 2024-01-17 Artur M. Schweidtmann , Dominik Bongartz , Alexander Mitsos

As retrieval-augmented generation prevails in large language models, embedding models are becoming increasingly crucial. Despite the growing number of general embedding models, prior work often overlooks the critical role of training data…

Computation and Language · Computer Science 2025-01-16 Xinshuo Hu , Zifei Shan , Xinping Zhao , Zetian Sun , Zhenyu Liu , Dongfang Li , Shaolin Ye , Xinyuan Wei , Qian Chen , Baotian Hu , Haofen Wang , Jun Yu , Min Zhang

Deep neural network ensembles hold the potential of improving generalization performance for complex learning tasks. This paper presents formal analysis and empirical evaluation to show that heterogeneous deep ensembles with high ensemble…

Computer Vision and Pattern Recognition · Computer Science 2023-10-04 Yanzhao Wu , Ka-Ho Chow , Wenqi Wei , Ling Liu

The aim of Few-Shot learning methods is to train models which can easily adapt to previously unseen tasks, based on small amounts of data. One of the most popular and elegant Few-Shot learning approaches is Model-Agnostic Meta-Learning…

Machine Learning · Computer Science 2024-07-09 M. Przewięźlikowski , P. Przybysz , J. Tabor , M. Zięba , P. Spurek

Materials science datasets are inherently heterogeneous and are available in different modalities such as characterization spectra, atomic structures, microscopic images, and text-based synthesis conditions. The advancements in multi-modal…

Machine Learning · Computer Science 2024-11-14 Janghoon Ock , Joseph Montoya , Daniel Schweigert , Linda Hung , Santosh K. Suram , Weike Ye

In recent years, machine learning (ML) has been proposed to devise data-driven parametrisations of unresolved processes in dynamical numerical models. In most cases, the ML training leverages high-resolution simulations to provide a dense,…

Computational Physics · Physics 2020-12-09 Julien Brajard , Alberto Carrassi , Marc Bocquet , Laurent Bertino
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