Results 231 to 240 of about 27,298 (312)

A case-based explainable graph neural network framework for mechanistic drug repositioning. [PDF]

Bioinformatics
Gonzalez-Cavazos AC, Tu R, Sinha M, Su AI.   +3 more
europepmc   +1 more source

Atomic‐Level Insight of Carbon‐Based Anodes for Advanced Sodium Storage: Electrochemical Mechanisms and Molecular Simulation‐Assisted Modification

cMat, Volume 3, Issue 2, June 2026.
Hard carbon is a promising anode for sodium‐ion batteries, yet its Na+ storage mechanism remains elusive. This review summarizes Na+ storage behavior in hard carbon from first‐principles (DFT) calculations, establishes structure–function relationships, summarizes DFT‐based evaluation methods, and provides perspectives for the rational theoretical ...
Yuefang Chen, Guoping Liu, Yuwen Zhao, Mengmeng Zhang, Yifang Zhang, Zhenyang Yu, Zhijia Zhang, Huijun Li, Yong Jiang   +8 more
wiley   +1 more source

Symmetric and Antisymmetric Quantum States from Graph Structure and Orientation. [PDF]

Entropy (Basel)
de Jesus MR, Hoefel EOC, Angelo RM.
europepmc   +1 more source

Optimizing the Collaborative Supply Scheduling of Renewable Energy in the Tourism Industry Chain Using Graph Neural Networks

Engineering Reports, Volume 8, Issue 6, June 2026.
Typical configuration of Huangshan Scenic Area. ABSTRACT To cope with the supply and demand imbalance challenge caused by the surge in energy demand in tourism‐intensive areas and the high volatility of renewable energy, this paper aims to construct a collaborative scheduling optimization model based on graph neural networks (GNNs). The model abstracts
Lixia Wang
wiley   +1 more source

Optimization Method for Robustness of Hypernetwork Communication with Integrated Structural Features. [PDF]

Entropy (Basel)
Chen L, Ma X, Ma F.
europepmc   +1 more source

Interpretable Tree‐Based Models for Predicting Short‐Term Rockburst Risk Considering Multiple Factors

Energy Science &Engineering, Volume 14, Issue 6, Page 2941-2960, June 2026.
Interpretable tree‐based models integrate microseismic, geological, and mining indicators to predict short‐term rockburst risk. SHAP analysis reveals the dominant role of energy‐related features and clarifies nonlinear factor interactions, enabling transparent and reliable early‐warning in deep coal mines.
Shuai Chen, Linming Dou, Atao Li, Wu Cai, Lei Zhang   +4 more
wiley   +1 more source

Neural subgraph counting on stream graphs via localized updates and monotonic learning. [PDF]

PLoS One
Xie Z, Hou W, Wu F, Xu H.
europepmc   +1 more source

Longitudinal Study of Adolescent Brain Connectivity Development Using Sign‐Aware Graph Theory Metrics

Human Brain Mapping, Volume 47, Issue 8, June 1, 2026.
ABSTRACT Adolescence is marked by significant changes in brain network organization that underlie cognitive and behavioral development. The sensorimotor‐association (SA) axis has been proposed as a hierarchical framework for understanding functional connectivity development, but most studies rely on cross‐sectional data and treat positive and negative ...
Subhasri Viswanathan, Sean Spinney, Jeremy J. Watts, Patricia Conrod   +3 more
wiley   +1 more source

Generating explainable hypotheses for drug repurposing with graph neural networks. [PDF]

Sci Rep
Perdomo-Quinteiro P, Guney E, Belmonte-Hernández A.   +2 more
europepmc   +1 more source