Neural Message Passing for Quantum Chemistry

4 April 2017

Justin Gilmer

Papers citing "Neural Message Passing for Quantum Chemistry"

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Title
FIT-GNN: Faster Inference Time for GNNs Using Coarsening Shubhajit Roy Hrriday Ruparel Kishan Ved Anirban Dasgupta GNN AI4CE 67 0 0 28 Jan 2025
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Field-level simulation-based inference with galaxy catalogs: the impact of systematic effects Natalí S. M. de Santi F. Villaescusa-Navarro L. Abramo Helen Shao Lucia A. Perez ... F. Marinacci D. Spergel K. Dolag L. Hernquist M. Vogelsberger 61 4 0 28 Jan 2025
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Higher-Order Topological Directionality and Directed Simplicial Neural Networks M. Lecha Andrea Cavallo Francesca Dominici Elvin Isufi Claudio Battiloro AI4CE 151 2 0 17 Jan 2025
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Enhancing Graph Self-Supervised Learning with Graph Interplay Xinjian Zhao Wei Pang Xiangru Jian Yaoyao Xu Chaolong Ying Tianshu Yu 51 0 0 17 Jan 2025
CureGraph: Contrastive Multi-Modal Graph Representation Learning for Urban Living Circle Health Profiling and Prediction Jinlin Li Xiao Zhou 38 0 0 13 Jan 2025
Optimality of Message-Passing Architectures for Sparse Graphs Aseem Baranwal K. Fountoulakis Aukosh Jagannath 81 11 0 10 Jan 2025
Data-Driven Radio Propagation Modeling using Graph Neural Networks Adrien Bufort Laurent Lebocq Stefan Cathabard GNN 46 3 0 08 Jan 2025
Graph Learning for Numeric Planning Dillon Z. Chen Sylvie Thiébaux 42 0 0 08 Jan 2025
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Geographical Information Alignment Boosts Traffic Analysis via Transpose Cross-attention Xiangyu Jiang Xiwen Chen Hao Wang Abolfazl Razi 63 0 0 03 Dec 2024
Multigraph Message Passing with Bi-Directional Multi-Edge Aggregations H. Çağrı Bilgi Lydia Y. Chen Kubilay Atasu 81 1 0 29 Nov 2024
RL-MILP Solver: A Reinforcement Learning Approach for Solving Mixed-Integer Linear Programs with Graph Neural Networks Tae-Hoon Lee Min-Soo Kim 81 0 0 29 Nov 2024
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