静磁场对生物体影响产生的潜在风险。静态磁场对碳水化合物影响的数值模拟

Q4 Environmental Science
BioRisk Pub Date : 2022-06-06 DOI:10.3897/biorisk.18.77001
W. Ciesielski, Tomasz Girek, Henryk Kołoczek, Zdzisław Oszczęda, J. Soroka, Piotr Tomasik
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引用次数: 1

摘要

背景:尝试识别不同磁通密度的静磁场对动植物的影响。为此,研究了SMF对α-和β- d -葡萄糖、α-和β- d -半乳糖、α-和β-果糖吡喃糖、α-和β-果糖呋喃糖、α-和β- d -木糖呋喃糖、α-和β- d -木糖吡喃糖分子的影响。方法:用硅芯片计算静磁场(SMF)在0.0、0.1、1、10和100 AFU (1 AFU > 1000 T)下对分子中电子密度分布的影响。利用Hyper-Chem 8.0软件结合AM1法对所研究的单糖分子的构象进行优化。然后用DFT 3-21G方法计算了放置在SMF中的分子的极化率、电荷分布、电势和偶极矩。结果:SMF的应用诱导了电子、原子和偶极子的极化,偶极子导致分子最终沿着分子的应用场重新取向和特定原子上的电子密度重新分布。场强的增加主要引起分子特定原子的电子密度和极化率的不规则变化。这些分子的能量和偶极矩也随SMF磁通密度的变化而变化。结论:生物体中存在的糖类可能通过将分子与酶结合,参与生物体对SMF的反应,影响体液中分子的代谢。细胞膜糖组分的结构变化会影响细胞膜的通透性。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Potential risk resulting from the influence of static magnetic field upon living organisms. Numerically-simulated effects of the static magnetic field upon carbohydrates
Background: Recognising effects of static magnetic field (SMF) of varying flux density on flora and fauna is attempted. For this purpose, the influence of SMF upon molecules of α- and β-D-glucose, α- and β-D-galactose, α- and β-fructopyranoses, α- and β-fructofuranoses and α- and β-D-xylofuranoses and α and β-D-xylopyranoses is studied. Methods: Computations of the effect of static magnetic field (SMF) of 0.0, 0.1, 1, 10 and 100 AFU (1 AFU > 1000 T) flux density were performed in silico for SMF changes distribution of the electron density in these molecules. Hyper-Chem 8.0 software was used together with the AM1 method for optimisation of the conformation of the molecules of monosaccharides under study. Then polarisability, charge distribution, potential and dipole moment for molecules placed in SMF were calculated involving DFT 3-21G method. Results: Application of SMF induced polarisability of electrons, atoms and dipoles, the latter resulting in eventual re-orientation of the molecules along the applied field of the molecules and the electron density redistribution at particular atoms. Increase in the field strength generated mostly irregular changes of the electron densities at particular atoms of the molecules as well as polarisabilities. Energy of these molecules and their dipole moments also varied with the SMF flux density applied. Conclusions: Saccharides present in the living organisms may participate in the response of the living organisms to SMF affecting metabolism of the molecules in the body fluids by fitting molecules to the enzymes. Structural changes of saccharide components of the cell membranes can influence the membrane permeability.
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来源期刊
BioRisk
BioRisk Environmental Science-Environmental Science (miscellaneous)
CiteScore
1.40
自引率
0.00%
发文量
44
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