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Papers matching “computational chemistry” 4

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Quantum chemistry
2025 Cambridge University Press eBooks book-chapter Computer Science Quantum Computing Algorithms and Architecture Open access

Sam McArdle, Connor T. Hann, Aleksander Kubica, Fernando G. S. L. Brandão

0

citations
Gas-Phase Chemistry of Solid-Fuel Particle Combustion
2026 Springer eBooks book-chapter Chemical Engineering Advanced Combustion Engine Technologies Open access

Francesca Loffredo, Raymond Langer, Maximilian Hellmuth, Sanket Girhe, Anita Meraviglia, Bingjie Chen, +1 more

0

citations
Quantum phase estimation
2025 Cambridge University Press eBooks book-chapter Computer Science Quantum Computing Algorithms and Architecture Open access

Sam McArdle, Connor T. Hann, Aleksander Kubica, Fernando G. S. L. Brandão

0

citations
Graph Neural Networks for the Prediction of Molecular Structure–Property Relationships
2023 Royal Society of Chemistry eBooks book-chapter Computer Science Computational Drug Discovery Methods

Jan G. Rittig, Qinghe Gao, Manuel Dahmen, Alexander Mitsos, Artur M. Schweidtmann

29

citations

4 results