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Many computational chemistry and molecular simulation workflows can be expressed as graphs. This abstraction is useful to modularize and potentially reuse existing components, as well as provide parallelization and ease reproducibility.…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-09-05 Thomas Löhr , Michele Assante , Michael Dodds , Lili Cao , Mikhail Kabeshov , Jon-Paul Janet , Marco Klähn , Ola Engkvist

Graph processing is used extensively in areas from social networking mining to web indexing. We demonstrate that the performance and dependability of such applications critically hinges on the graph data structure used, because a fixed,…

Programming Languages · Computer Science 2014-12-30 Amlan Kusum , Iulian Neamtiu , Rajiv Gupta

Graph learning from data represents a canonical problem that has received substantial attention in the literature. However, insufficient work has been done in incorporating prior structural knowledge onto the learning of underlying…

Machine Learning · Statistics 2019-04-23 Sandeep Kumar , Jiaxi Ying , José Vinícius de M. Cardoso , Daniel Palomar

Equations system constructors of hierarchical circuits play a central role in device modeling, nonlinear equations solving, and circuit design automation. However, existing constructors present limitations in applications to different…

To enable heterogeneous computing systems with autonomous programming and optimization capabilities, we propose a unified, end-to-end, programmable graph representation learning (PGL) framework that is capable of mining the complexity of…

Machine Learning · Computer Science 2022-04-27 Yao Xiao , Guixiang Ma , Nesreen K. Ahmed , Mihai Capota , Theodore Willke , Shahin Nazarian , Paul Bogdan

The graph is one of the most widely used mathematical structures in engineering and science because of its representational power and inherent ability to demonstrate the relationship between objects. The objective of this work is to…

Data Structures and Algorithms · Computer Science 2021-01-01 Shri Prakash Dwivedi

Previous efforts on reconfigurable analog circuits mostly focused on specialized analog circuits, produced through careful co-design, or on highly reconfigurable, but relatively resource inefficient, accelerators that implement analog…

Programming Languages · Computer Science 2023-10-11 Yu-Neng Wang , Glenn Cowan , Ulrich Rührmair , Sara Achour

Finding frequently occurring subgraph patterns or network motifs in neural architectures is crucial for optimizing efficiency, accelerating design, and uncovering structural insights. However, as the subgraph size increases,…

Machine Learning · Computer Science 2026-02-04 Yikang Yang , Zhengxin Yang , Minghao Luo , Luzhou Peng , Hongxiao Li , Wanling Gao , Lei Wang , Jianfeng Zhan

Surrogate models driven by sizeable datasets and scientific machine-learning methods have emerged as an attractive microstructure simulation tool with the potential to deliver predictive microstructure evolution dynamics with huge savings…

Materials Science · Physics 2024-01-22 Shaoxun Fan , Andrew L. Hitt , Ming Tang , Babak Sadigh , Fei Zhou

With the increase of graph size, it becomes difficult or even impossible to visualize graph structures clearly within the limited screen space. Consequently, it is crucial to design effective visual representations for large graphs. In this…

Social and Information Networks · Computer Science 2024-08-30 Hong Zhou , Peifeng Lai , Zhida Sun , Xiangyuan Chen , Yang Chen , Huisi Wu , Yong Wang

Real-world optimization problems are generally not just black-box problems, but also involve mixed types of inputs in which discrete and continuous variables coexist. Such mixed-space optimization possesses the primary challenge of modeling…

Machine Learning · Computer Science 2022-02-09 Jaeyeon Ahn , Taehyeon Kim , Seyoung Yun

Deep Learning has made a great progress for these years. However, it is still difficult to master the implement of various models because different researchers may release their code based on different frameworks or interfaces. In this…

Software Engineering · Computer Science 2017-07-28 Ting Pan

GPUs are widely used to accelerate many important classes of workloads today. However, we observe that several important emerging classes of workloads, including simulation engines for deep reinforcement learning and dynamic neural…

Hardware Architecture · Computer Science 2024-01-24 Sankeerth Durvasula , Adrian Zhao , Raymond Kiguru , Yushi Guan , Zhonghan Chen , Nandita Vijaykumar

Graphs are becoming one of the most popular data modeling paradigms since they are able to model complex relationships that cannot be easily captured using traditional data models. One of the major tasks of graph management is graph…

Databases · Computer Science 2013-11-12 Carlos R. Rivero , Hasan M. Jamil

A growing trend in modern data analysis is the integration of data management with learning, guided by accuracy, latency, and cost requirements. In practice, applications draw data of different formats from many sources. In the meanwhile,…

Databases · Computer Science 2025-10-15 Meihui Zhang , Liming Wang , Chi Zhang , Zhaojing Luo

Subgraph matching has garnered increasing attention for its diverse real-world applications. Given the dynamic nature of real-world graphs, addressing evolving scenarios without incurring prohibitive overheads has been a focus of research.…

Distributed, Parallel, and Cluster Computing · Computer Science 2024-01-31 Linshan Qiu , Lu Chen , Hailiang Jie , Xiangyu Ke , Yunjun Gao , Yang Liu , Zetao Zhang

GraphRAG integrates (knowledge) graphs with large language models (LLMs) to improve reasoning accuracy and contextual relevance. Despite its promising applications and strong relevance to multiple research communities, such as databases and…

Artificial Intelligence · Computer Science 2025-08-20 Yukun Cao , Zengyi Gao , Zhiyang Li , Xike Xie , S. Kevin Zhou , Jianliang Xu

Globally consistent dense maps are a key requirement for long-term robot navigation in complex environments. While previous works have addressed the challenges of dense mapping and global consistency, most require more computational…

By optimizing aesthetics, graph diagrams can be generated that are easier to read and understand. However, the challenge lies in identifying suitable aesthetics. We present a novel approach based on repertory grids to explore the design…

Human-Computer Interaction · Computer Science 2020-08-19 David Baum

The specific characteristics of graph workloads make it hard to design a one-size-fits-all graph storage system. Systems that support transactional updates use data structures with poor data locality, which limits the efficiency of…

Databases · Computer Science 2020-09-01 Xiaowei Zhu , Guanyu Feng , Marco Serafini , Xiaosong Ma , Jiping Yu , Lei Xie , Ashraf Aboulnaga , Wenguang Chen