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Updated: Jun 28, 2025

Quaternary Structure Modeling Through Chemical Cross-Linking Mass Spectrometry: Extending TX-MS Jupyter Reports
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在和替代型醇中进行键分析:重叠描述符,局部模式分析和QTAIM

Willis G Barbosa1, Carlos V Santos-Jr2, Railton B Andrade1

  • 1Department of Chemistry, State University of Paraiba, Campina Grande, 58429-500, PB, Brazil.

Journal of molecular modeling
|April 19, 2024
PubMed
概括

这项研究使用计算方法来分析替代醇中的化学键. 它揭示了替代剂如何影响S-H和C-S键特性和分子稳定性.

关键词:
化学键的重叠是化学键的重叠.电子捐赠效应是一种电子捐赠效应.当地的振动模式.在QTAIM中,QTAIM是QTAIM.铁类醇 (Thiophenols) 是一种类醇.

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