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Updated: Jun 11, 2025

In Silico Clinical Trials for Cardiovascular Disease
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使用基于希尔什菲尔德分区和相互作用区域指标的独立梯度模型绘制腺酸盐和米诺西迪尔硫酸盐的相互作用景观

Sneha Anna Sunny1,2, Ananya Prakash2,3, Rafa Almeer4

  • 1Department of Chemistry, St Berchmans College (Autonomous), Changanassery, Kottayam 686101, Kerala, India.

The journal of physical chemistry. B
|September 27, 2024
PubMed
概括

这项研究使用计算方法研究了腺和矿氧化硫酸盐的相互作用. 我们发现热力学上有利的复合体形成具有显著的键,表明动力稳定性和弱非对应相互作用.

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