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Charge Equilibration Layer for Long-range Interactions

technology1 mentionslast seen Oct 14, 2026

Novel architecture that extends GNN potentials to model non-local molecular interactions including charge transfer, electrostatic and dispersion effects.

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Charge Equilibration Layer for Long-range Interactions

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Charge Equilibration Layer for Long-range Interactionsapplies tomolecular simulation

82% confidence1 supporting mentions

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