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Large-Scale Molecular Dynamics Simulation Based on Heterogeneous Many-Core Architecture.
Xu Zhou
Zhiqiang Wei
Hao Lu
Jiaqi He
Yuan Gao
Xiaotong Hu
Cunji Wang
Yujie Dong
Hao Liu
Published in:
J. Chem. Inf. Model. (2024)
Keyphrases
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molecular dynamics
high performance computing
data mining
management system
scientific data
computer vision
information systems
protein folding
query processing
scheduling problem
numerical simulations
molecular dynamics simulations