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1.
Ilaria Fraudentali Renato A. Rodrigues-Pousada Riccardo Angelini Sandip A. Ghuge Alessandra Cona 《International journal of molecular sciences》2021,22(10)
Polyamines are ubiquitous, low-molecular-weight aliphatic compounds, present in living organisms and essential for cell growth and differentiation. Copper amine oxidases (CuAOs) oxidize polyamines to aminoaldehydes releasing ammonium and hydrogen peroxide, which participates in the complex network of reactive oxygen species acting as signaling molecules involved in responses to biotic and abiotic stresses. CuAOs have been identified and characterized in different plant species, but the most extensive study on a CuAO gene family has been carried out in Arabidopsis thaliana. Growing attention has been devoted in the last years to the investigation of the CuAO expression pattern during development and in response to an array of stress and stress-related hormones, events in which recent studies have highlighted CuAOs to play a key role by modulation of a multilevel phenotypic plasticity expression. In this review, the attention will be focused on the involvement of different AtCuAOs in the IAA/JA/ABA signal transduction pathways which mediate stress-induced phenotypic plasticity events. 相似文献
2.
Dr. Laurent David Dr. Mark Wenlock Dr. Patrick Barton Dr. Andreas Ritzén 《ChemMedChem》2021,16(17):2669-2685
Chameleonic properties, i. e., the capacity of a molecule to hide polarity in non-polar environments and expose it in water, help achieving sufficient permeability and solubility for drug molecules with high MW. We present models of experimental measures of polarity for a set of 24 FDA approved drugs (MW 405-1113) and one PROTAC (MW 1034). Conformational ensembles in aqueous and non-polar environments were generated using molecular dynamics. A linear regression model that predicts chromatographic apparent polarity (EPSA) with a mean unsigned error of 10 Å2 was derived based on separate terms for donor, acceptor, and total molecular SASA. A good correlation (R2=0.92) with an experimental measure of hydrogen bond donor potential, Δlog Poct-tol, was found for the mean hydrogen bond donor SASA of the conformational ensemble scaled with Abraham's A hydrogen bond acidity. Two quantitative measures of chameleonic behaviour, the chameleonic efficiency indices, are introduced. We envision that the methods presented herein will be useful to triage designed molecules and prioritize those with the best chance of achieving acceptable permeability and solubility. 相似文献
3.
某飞机用30CrMnSiA钢沉头螺栓在拆卸过程中发生断裂,同炉批未曾使用的螺栓经磁粉检测也存在裂纹。为查找失效分析原因,通过对断裂件和同炉批开裂的螺栓外观检查、断口宏微观分析、能谱分析、硬度检测、金相分析等方法对断裂和开裂的螺栓进行了分析。结果表明:断裂螺栓和开裂螺栓断裂类型为氢脆,螺栓氢脆断裂主要与抗拉强度和热处理工艺有关,通过改善热处理工艺参数,适当降低螺栓的强度,增加酸洗后的除氢时间降低氢含量,从而避免氢脆发生的可能性。 相似文献
4.
凝胶是一种性质介于固体和液体之间的特殊分散体系,魔芋葡甘聚糖(KGM)凝胶稳定性差、强度低,物理共混能方便、快捷地改善其凝胶性质。主要综述KGM复合凝胶的网络结构变化,并介绍不同复合凝胶在食品、医药、材料工程等领域的应用。分析表明,KGM复合凝胶网络能通过氢键、席夫碱反应、形成多重网络结构和填充的方式改善其凝胶特性。 相似文献
5.
Xing-Ya Liu Rui-Yang Xie Tao Chen Lei He Ting Wang Wang Liao Zhi-Guo Liu Ming-Jun Chen 《应用聚合物科学杂志》2021,138(47):51411
Due to the condensation reaction of hydroxylated melamine molecules is possible to take place in the whole pH range, especially in acidic water medium or at high temperature, losing its water solubility. In this work, freeze drying perfectly removes water at pretty low temperature, avoiding condensation reaction of hydroxylated melamine. Therefore, a hydroxylated melamine in solid form (MOH-S) was prepared. It can be not only dissolved in water after storing for 180 days but also well dispersed in waterborne polyurethane emulsion. The addition of hydroxylated melamine significantly improves the tensile strength of polyurethane films by 170%. After soaking the films in water for 24 h, the tensile strength of WPU/30%MOH-S film lost only 6%, but 34% loss for the neat. Fourier transform infrared spectroscopy peak fitting demonstrates that the H-bonding degree of N─H in WPU/30%MOH-S film is 20.72 that is much higher than 3.33 in neat WPU. This indicates that H-bonding cross-linked structure is formed between polyurethane chains and hydroxylated melamine molecules. This work provides an effective strategy for preparing stable hydroxylated melamine and enhancing the strength of polyurethane film. 相似文献
6.
近年氢能已迅速成为能源领域“新宠”,正在迎来快速发展的战略机遇期,但氢安全问题仍然是制约其发展的关键,尤以高压氢气储运设施泄漏后引发喷射火灾害较为突出。为了探究高压氢气泄漏过程并对其引发喷射火灾特性参数变化进行评估,本文采用理论分析和实例验证相结合的方法对两起高压氢气泄漏实验案例(90 MPa氢气瓶和6 MPa氢气管道)进行了研究。结果表明:通过模型精度检验,Abel-Nobel气体状态方程适用于当前常用的多种高压氢气储运设施泄漏过程的描述。基于Abel-Nobel气体状态方程、火焰尺寸模型、辐射分数模型和热辐射模型构建的高压氢气泄漏喷射火过程预测模型对实验案例中的泄漏出口气体质量流量、氢喷射火焰长度和辐射热场等的模拟计算结果与实验测量数据基本一致,验证了模型有效性及所含假设合理性。另外在计算中还需要结合实际情况充分考虑高压氢气储运设施发生泄漏时产生的能量损失以及等温流动过程,从而对模型预测精度进行修正。上述结论对于工程实际、氢能安全利用以及灾害预防等具有重要现实意义。 相似文献
7.
8.
在高含硫化氢的页岩气开采过程中,硫化氢的实时监测尤为重要,非常态情况下如钻井过程中突发硫化氢泄漏事故,极易造成人员中毒,事故井及周围人员需全部撤离并切断井场电源,严重时要对事故井采取非常措施处理。常规硫化氢的监测因非常态情况下井场没有电源而无法正常工作,非常态无线硫化氢监测系统的设计研制有效解决了硫化氢实时监测的问题。系统采用锂电池供电,完全独立于井场电源,低功耗设计使系统在单电池供电的情况下可长时间连续工作;采用无线通信方式,方便现场安装和移动。由于多主机同时在线工作,各主机独立工作互不影响,可满足多点监测需求,可随意添加无线中继,方便扩展监测范围,能够在远离事故井的地方实时监测硫化氢气体。通过采集监测软件可实时显示硫化氢数据和曲线,数据实时存储,并能导出多种文件格式,方便数据查看和回放。现场测试结果表明,系统能够实现在非常态情况下硫化氢的实时监测,满足现场应用需求。 相似文献
9.
采用第一性原理计算方法研究了H原子在立方TiC 晶格中的结构稳定性及扩散行为。结果表明:H原子在TiC晶格中的最稳定位点位于Ti/C六面体中靠近C原子的C-H(C-HS)位置,H被C原子捕获而形成C—H键,键长1.15 Å(1 Å=0.1 nm),零点修正(ZPE)后形成能为1.58 eV;其次是Ti/C六面体中心位置(CS),H 原子主要与Ti原子成键,ZPE修正后的形成能为1.75 eV。采用CI-NEB方法计算预测了TiC晶格中H间隙原子的最优扩散路径,即先在Ti/C六面体内沿(110)晶面进行“跳跃”扩散,扩散势垒为0.47 eV;然后以C原子为中心,沿(100)晶面进行两次“旋转”扩散穿越Ti/C原子面,扩散势垒为0.28 eV。 相似文献
10.
Developing non-platinum group metal (non-PGM) electrocatalysts for the hydrogen oxidation reaction (HOR) represents the efforts towards the more economical use of hydrogen fuel cells and hydrogen energy, which has attracted tremendous attention recently. However, non-PGM electrocatalysts for the HOR are still in their early development stages as compared with the significant advances in those for the oxygen reduction reaction and hydrogen evolution reaction. Herein, this paper summarizes the recent progresses and highlights the key challenges for the rational design of non-PGM electrocatalysts, aiming to promote the development of non-PGM HOR electrocatalysts. Fundamental understandings of the HOR mechanism are firstly reviewed, where theoretical interpretations on the low HOR kinetics in alkaline media, including the hydrogen binding energy theory, the bifunctional mechanism, and the water molecule reorganization, are particularly discussed. Subsequently, progresses of typical non-PGM HOR electrocatalysts in acid and alkaline media are summarized separately. For the HOR under alkaline conditions, the superiorities and challenges of Ni-based catalysts are discussed with a particular focus as they are the most promising non-PGM electrocatalysts. Finally, this paper highlights the challenges and provide perspectives on the future development directions of non-PGM HOR electrocatalysts. 相似文献