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How to obtain informative representations of transactions and then perform the identification of fraudulent transactions is a crucial part of ensuring financial security. Recent studies apply Graph Neural Networks (GNNs) to the transaction…

Machine Learning · Computer Science 2023-07-12 Yue Tian , Guanjun Liu

Determination of atomic structures is a key challenge in the fields of computational physics and materials science, as a large variety of mechanical, chemical, electronic, and optical properties depend sensitively on structure. Here, we…

Computational Physics · Physics 2021-06-02 Sami Kaappa , Estefanía Garijo del Río , Karsten Wedel Jacobsen

State-of-the-art named entity recognition (NER) systems have been improving continuously using neural architectures over the past several years. However, many tasks including NER require large sets of annotated data to achieve such…

Machine Learning · Computer Science 2020-01-22 Parminder Bhatia , Kristjan Arumae , Busra Celikkaya

Graph neural networks (GNNs) have achieved remarkable success across a wide range of applications, such as recommendation, drug discovery, and question answering. Behind the success of GNNs lies the backpropagation (BP) algorithm, which is…

Machine Learning · Computer Science 2024-04-16 Namyong Park , Xing Wang , Antoine Simoulin , Shuai Yang , Grey Yang , Ryan Rossi , Puja Trivedi , Nesreen Ahmed

We propose Efficient Neural Architecture Search (ENAS), a fast and inexpensive approach for automatic model design. In ENAS, a controller learns to discover neural network architectures by searching for an optimal subgraph within a large…

Machine Learning · Computer Science 2018-02-13 Hieu Pham , Melody Y. Guan , Barret Zoph , Quoc V. Le , Jeff Dean

Graph Neural Networks (GNNs) have demonstrated remarkable results in various real-world applications, including drug discovery, object detection, social media analysis, recommender systems, and text classification. In contrast to their vast…

Machine Learning · Computer Science 2026-02-04 Nícolas Roque dos Santos , Dawon Ahn , Diego Minatel , Alneu de Andrade Lopes , Evangelos E. Papalexakis

Graph Neural Networks (GNNs) have shown exceptional success in graph representation learning and a wide range of real-world applications. However, scaling deeper GNNs poses challenges due to the neighbor explosion problem when training on…

Machine Learning · Computer Science 2025-11-18 Rui Xue

Pumped-storage hydropower plants (PSH) actively participate in grid power-frequency control and therefore often operate under dynamic conditions, which results in rapidly varying system states. Predicting these dynamically changing states…

Machine Learning · Computer Science 2024-08-22 Raffael Theiler , Olga Fink

We propose a simple scheme to estimate potential energy surface (PES) with which the accuracy can be easily controlled and improved up to the level of the density functional theory (DFT) calculations. It is based on a model selection within…

Materials Science · Physics 2014-07-11 Atsuto Seko , Akira Takahashi , Isao Tanaka

This paper proposes a data-driven graphical framework for the real-time search of risky cascading fault chains (FCs). While identifying risky FCs is pivotal to alleviating cascading failures, the complex spatio-temporal dependencies among…

Systems and Control · Electrical Eng. & Systems 2023-03-17 Anmol Dwivedi , Ali Tajer

Graph Neural Networks (GNNs) have demonstrated remarkable efficacy in handling graph-structured data; however, they exhibit failures after deployment, which can cause severe consequences. Hence, conducting thorough testing before deployment…

Software Engineering · Computer Science 2025-12-23 Lichen Yang , Qiang Wang , Zhonghao Yang , Daojing He , Yu Li

Recent years have witnessed the popularity of Graph Neural Networks (GNN) in various scenarios. To obtain optimal data-specific GNN architectures, researchers turn to neural architecture search (NAS) methods, which have made impressive…

Machine Learning · Computer Science 2020-09-08 Huan Zhao , Lanning Wei , Quanming Yao

This paper investigates the intriguing question of whether we can create learning algorithms that automatically generate training data, learning environments, and curricula in order to help AI agents rapidly learn. We show that such…

Machine Learning · Computer Science 2019-12-18 Felipe Petroski Such , Aditya Rawal , Joel Lehman , Kenneth O. Stanley , Jeff Clune

The work function and cleavage energy of a surface are critical properties that determine the viability of materials in electronic emission applications, semiconductor devices, and heterogeneous catalysis. While first principles…

Materials Science · Physics 2026-01-12 Circe Hsu , Claire Schlesinger , Karan Mudaliar , Jordan Leung , Robin Walters , Peter Schindler

Dielectrophoretic (DEP) sensing is an extremely important sensing modality that enables the rapid capture and detection of polarizable particles of nano-scale size. This makes it a versatile tool for applications in medical diagnostics,…

Mesoscale and Nanoscale Physics · Physics 2025-11-26 Nezhueyotl Izquierdo , Ruixue Li , Peter R. Christenson , Sang-Hyun Oh , Steven J. Koester

In the realm of EEG decoding, enhancing the performance of artificial neural networks (ANNs) carries significant potential. This study introduces a novel approach, termed "weight freezing", that is anchored on the principles of ANN…

Machine Learning · Computer Science 2023-06-13 Zhengqing Miao , Meirong Zhao

Optimal dispatch of energy storage systems (ESSs) in distribution networks involves jointly improving operating economy and voltage security under time-varying conditions and possible topology changes. To support fast online decision…

Machine Learning · Computer Science 2026-03-30 Shuyi Gao , Stavros Orfanoudakis , Shengren Hou , Peter Palensky , Pedro P. Vergara

Aiming at two molecular graph datasets and one protein association subgraph dataset in OGB graph classification task, we design a graph neural network framework for graph classification task by introducing PAS(Pooling Architecture Search).…

Machine Learning · Computer Science 2022-07-14 Xu Wang , Huan Zhao , Lanning Wei , Quanming Yao

In many real world applications, data are characterized by a complex structure, that can be naturally encoded as a graph. In the last years, the popularity of deep learning techniques has renewed the interest in neural models able to…

Machine Learning · Computer Science 2020-04-20 Matteo Tiezzi , Giuseppe Marra , Stefano Melacci , Marco Maggini , Marco Gori

The incessant advent of online services demands high speed and efficient recommender systems (ReS) that can maintain real-time performance along with processing very complex user-item interactions. The present study, therefore, considers…

Machine Learning · Computer Science 2025-07-03 Yushang Zhao , Haotian Lyu , Yike Peng , Aijia Sun , Feng Jiang , Xinyue Han