Abstract: The Graph Isomorphism (GI) problem has been extensively studied due to its significant applications. The most effective class of GI algorithms, i.e., canonical labeling algorithms, are ...

Melty Molecule is a molecular property prediction system that leverages graph neural networks to predict melting points of chemical compounds. The model uses a hybrid architecture combining Principal ...

Graph cover problems form a critical area within discrete optimisation and theoretical computer science, addressing the challenge of selecting subsets of vertices (or edges) that satisfy predetermined ...

Artificial intelligence (AI) is the new arms race and the centerpiece of defense modernization efforts across multiple countries, including the United States. Yet, despite the surge in AI investments, ...

Researchers have successfully used a quantum algorithm to solve a complex century-old mathematical problem long considered impossible for even the most powerful conventional supercomputers. The ...

A Python implementation of a graph isomorphism algorithm based on gossip fingerprinting. The algorithm computes structural fingerprints for graph vertices to determine isomorphism. The gossip ...

ABSTRACT: To effectively evaluate a system that performs operations on UML class diagrams, it is essential to cover a large variety of different types of diagrams. The coverage of the diagram space ...

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To effectively evaluate a system that performs operations on UML class diagrams, it is essential to cover a large variety of different types of diagrams. The coverage of the diagram space can be ...

Creative Commons (CC): This is a Creative Commons license. Attribution (BY): Credit must be given to the creator. Accurately modeling chemical reactions in molecular dynamics simulations requires ...