An overview on the application of graph neural networks in wireless networks

S He, S **ong, Y Ou, J Zhang, J Wang… - IEEE Open Journal …, 2021‏ - ieeexplore.ieee.org
In recent years, with the rapid enhancement of computing power, deep learning methods
have been widely applied in wireless networks and achieved impressive performance. To …

Geometric deep learning for drug discovery

M Liu, C Li, R Chen, D Cao, X Zeng - Expert Systems with Applications, 2024‏ - Elsevier
Drug discovery is a time-consuming and expensive process. With the development of
Artificial Intelligence (AI) techniques, molecular Geometric Deep Learning (GDL) has …

Geometry-enhanced molecular representation learning for property prediction

X Fang, L Liu, J Lei, D He, S Zhang, J Zhou… - Nature Machine …, 2022‏ - nature.com
Effective molecular representation learning is of great importance to facilitate molecular
property prediction. Recent advances for molecular representation learning have shown …

Graph neural networks for anomaly detection in industrial Internet of Things

Y Wu, HN Dai, H Tang - IEEE Internet of Things Journal, 2021‏ - ieeexplore.ieee.org
The Industrial Internet of Things (IIoT) plays an important role in digital transformation of
traditional industries toward Industry 4.0. By connecting sensors, instruments, and other …

Structure-aware interactive graph neural networks for the prediction of protein-ligand binding affinity

S Li, J Zhou, T Xu, L Huang, F Wang, H **ong… - Proceedings of the 27th …, 2021‏ - dl.acm.org
Drug discovery often relies on the successful prediction of protein-ligand binding affinity.
Recent advances have shown great promise in applying graph neural networks (GNNs) for …

Geomgcl: Geometric graph contrastive learning for molecular property prediction

S Li, J Zhou, T Xu, D Dou, H **ong - … of the AAAI conference on artificial …, 2022‏ - ojs.aaai.org
Recently many efforts have been devoted to applying graph neural networks (GNNs) to
molecular property prediction which is a fundamental task for computational drug and …

Quest: systematically approximating quantum circuits for higher output fidelity

T Patel, E Younis, C Iancu, W de Jong… - Proceedings of the 27th …, 2022‏ - dl.acm.org
We present QUEST, a procedure to systematically generate approximations for quantum
circuits to reduce their CNOT gate count. Our approach employs circuit partitioning for …

Graph convolutional networks in language and vision: A survey

H Ren, W Lu, Y **ao, X Chang, X Wang, Z Dong… - Knowledge-Based …, 2022‏ - Elsevier
Graph convolutional networks (GCNs) have a strong ability to learn graph representation
and have achieved good performance in a range of applications, including social …

Neural Bayes estimators for irregular spatial data using graph neural networks

M Sainsbury-Dale, A Zammit-Mangion… - … of Computational and …, 2024‏ - Taylor & Francis
Neural Bayes estimators are neural networks that approximate Bayes estimators in a fast
and likelihood-free manner. Although they are appealing to use with spatial models, where …

SS-GNN: a simple-structured graph neural network for affinity prediction

S Zhang, Y **, T Liu, Q Wang, Z Zhang, S Zhao… - ACS …, 2023‏ - ACS Publications
Efficient and effective drug-target binding affinity (DTBA) prediction is a challenging task due
to the limited computational resources in practical applications and is a crucial basis for drug …