Conformational analysis of milk derived tripeptides, IPP, VPP and LPP, and investigation of their anti-COVID-19 potentials by molecular docking and molecular dynamics studies

IF 0.7 4区化学 Q4 CHEMISTRY, MULTIDISCIPLINARY

Molecular Crystals and Liquid Crystals Pub Date : 2024-02-20 DOI:10.1080/15421406.2024.2318080

Sefa Celik, Sevim Akyuz, Gulshen Agaeva, Aysen E. Ozel, Niftali M. Qocayev, Ulker Agaeva

引用次数: 0

Abstract

Milk derived tripeptides IPP(Ile-Pro-Pro), VPP(Val-Pro-Pro) and LPP(Leu-Pro-Pro) have inhibitory effects on angiotensin converting enzyme, which plays a fundamental role in blood pressure systems. ...

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牛奶衍生三肽 IPP、VPP 和 LPP 的构象分析，以及通过分子对接和分子动力学研究调查其抗 COVID-19 的潜力

牛奶提取的三肽 IPP（Ile-Pro-Pro）、VPP（Val-Pro-Pro）和 LPP（Leu-Pro-Pro）对血管紧张素转换酶有抑制作用，而血管紧张素转换酶在血压系统中起着重要作用。...

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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来源期刊

Molecular Crystals and Liquid Crystals 化学-晶体学

CiteScore

1.20

自引率

14.30%

发文量

248

审稿时长

2 months

期刊介绍： Established in 1966, Molecular Crystals and Liquid Crystals is a world-leading journal publishing original research papers in both an experimental and theoretical nature in three areas of specialization: liquid crystals, molecular crystals, and low-dimensional solids. These cover, but are not limited to: Liquid Crystals: -Electro- and magneto-optical phenomena; thermodynamics; phase transitions; structure; NMR and orientation-controlled spectroscopy; theory. Molecular Crystals: -Spectroscopy; energy and charge transfer; solid state reactions; photo and radiation effects Low-dimensional Solids: -Structure, electronic, magnetic, and optical properties; transport mechanisms The journal publishes research papers, review papers, and book reviews. In all three areas, experimental manuscripts describing both preparation and properties will be considered. Papers that describe determination of crystal structure alone are not encouraged unless some solid state forces (hydrogen bonding, charge transfer, etc.) are playing a significant role and/or some solid state properties of the materials are measured.