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Zhen Huang
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2026 / Manuscript in preparation

Isotropic Periodic Sum for Learning Classical Interactions with Finite-Cutoff Graph Neural Networks

Zhen Huang, Yong Duan, Xiongwu Wu, Ray Luo

In preparation

Isotropic periodic sum methods for learning classical interactions with finite-cutoff graph neural networks. Manuscript in preparation.

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Selected papers

A Density-Consistent, Finite van der Waals Potential from Gaussian Atomic DensitiesDEGAUSS: A Novel Softcore Force Field Using Double Exponential van der Waals and Gaussian Charge for Molecular Dynamics Simulations I: Theory and ValidationIsotropic Periodic Sum for Polarizable Gaussian Multipole ModelPerformance Tuning of Polarizable Gaussian Multipole Model in Molecular Dynamics SimulationsOptimal Scheme to Achieve Energy Conservation in Induced Dipole Models
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