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Example Data of Polymers and Their Computed Property from MD Simulations

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IEEE2026-04-17 收录
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https://ieee-dataport.org/documents/example-data-polymers-and-their-computed-property-md-simulations
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Through large-scale molecular dynamics simulations, we have obtained computational data for over 5,500 different polymers. This dataset focuses on the density of each polymer, and also includes information on molecular weight and the number of electrons per atom.
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Hiroto Yokoyama
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