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Updated: Jul 18, 2025

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基于机器学习的聚胺材料的属性预测和结构特征提取

Han Zhang1, Haoyuan Li1, Hanshen Xin1

  • 1School of Microelectronics, Shanghai University, Shanghai 201800, China.

Journal of chemical information and modeling
|August 24, 2023
PubMed
概括

机器学习模型准确地预测了聚胺的光学特性和玻璃过渡温度. 分子弹性和原子位置是影响这些特性的关键因素,有助于灵活的显示材料的开发.

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Polymers are classified as linear or branched on the basis of their chain architecture. The polymer chains in linear polymers have a long chain-like structure with minimal to no branching at all. Even if a polymer features large substituent groups on the monomer, which appear as branches to the skeleton, it is not considered a branched polymer. A branched polymer contains secondary polymer chains that arise from the main polymer chain. The branching occurs when the polymer growth shifts from...
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