黄酮类化合物抑制MMP-9的定量结构-活性关系和结构修饰的理论研究

运用密度泛函理论(DFT)和线性回归分析等方法研究了黄酮类化合物抑制MMP-9的定量结构-活性关系(QSAR)和结构修饰. 研究发现, 黄酮类化合物抑制MMP-9的实验生物活性数据－lg EC₅₀值与计算获得的黄酮类化合物的最低空分子轨道能量及分子水合能之间均存在着良好的线性关系|留一法交叉验证结果表明, 所建立的两个相应的QSAR模型都具有良好的稳定性和预测能力. 进一步研究发现, 在黄酮类化合物分子的A环、B环和C环上的合适部位选用供电子能力较强、能降低分子水合能的取代基团对其进行结构修饰, 有利于提高修饰后的分子抑制MMP-9的生物活性. 根据对木犀草素(Luteolin)分子进行结构修饰的结果(共33种化合物), 我们提出了黄酮类化合物抑制MMP-9可能的作用机理, 并设计出8种经结构修饰后生物活性有显著提高的MMP-9抑制剂, 希望将来得到实验的证实.     

基于3D固态负极的铁铅单液流电池研究

低成本的大规模电化学储能技术对于清洁可再生能源的高效利用具有重要意义.设计了一种3D结构的铅负极,并在此基础上构建了铁铅单液流电池.其中采用硫酸亚铁/硫酸铁和铅/硫酸铅分别作为电池的正、负极活性物质,硫酸水溶液为电解液.负极采用高导电的乙炔黑构建了具有多孔结构的导电网络,并通过加入硫酸钡或腐殖酸等添加剂显著提升了电池性...     

非晶Nd8Fe86B6合金快速晶化过程中的组织变化与磁性能

利用高频感应加热,对熔体快淬Nd8Fe86B6非晶薄带进行了快速晶化退火,并对退火后薄带的微观组织及磁学性能进行了分析.结果表明,快速加热可使非晶带迅速晶化.加热速度强烈地影响薄带的组织和磁性能.不同的加热速度下,都有一个最佳的得到较高磁学性能的加热时间与它相配合.当加热工艺为 加热电压5 kV,加热时间10 s时,晶化后的薄带磁性能可达(BH)max=105 kJ·m-3,Br=0.93 T,Hci=258 kA·m-1.     

Tensile property of cord reinforced rubber composites laminate double lap jointEI北大核心CSCD

According to the structural connection form of cord reinforced rubber composite，structural test samples with different lapping process parameters were designed and prepared. The dynamic and static tensile properties were studied by using two-dimensional digital image technology. The test results were as follows：The stiffness and tensile strength of double lap composites joints increased as the strain rate increasing，while the elongation at break unchanged. Compared with the no-lap samples，the tensile strength of the double lap composites sample was reduced by nearly 50%，and with the increase of the lap width，the elongation at break gradually decreased. The samples with lap width of 65 mm decreased by 24% compared with the no-lap ones. Compared with the elastic modulus of stage II，the elastic modulus of stage III increased significantly，that of the no-lap samples increased by 3 times，that of the lap samples were doubled，and the amplification of elastic modulus decreased with the increase of strain rate. © 2023, Youke Publishing Co.,Ltd. All rights reserved.