"Parallelization Strategies for DeepMD-Kit Using OpenMP: Enhancing ..."

Qi Du, Feng Wang, Chengkun Wu (2025)

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DOI: 10.1109/TC.2025.3595078

access: closed

type: Journal Article

metadata version: 2025-10-15

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Qi Du, Feng Wang, Chengkun Wu:
Parallelization Strategies for DeepMD-Kit Using OpenMP: Enhancing Efficiency in Machine Learning-Based Molecular Simulations. IEEE Trans. Computers 74(10): 3534-3545 (2025)

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