异或链及其在药性数据预处理中的应用

异或链具有灵活、易编辑、高效率、低存储的特点.在将异或链与传统双向链表的对比中,异或链具有较为明显的优势.在药性判别模型的建立过程中,采用异或链和传统双向链表来处理大量药性数据,使得药性预处理工作变得更加高效、方便、灵活、准确.效率对比结果表明异或链比传统双向链表在药性预处理中快25.7％.     

Activated carbon prepared from polyaniline base by K2CO3 activation for application in supercapacitor electrodes

An activated carbon was prepared from a polyaniline base using K₂CO₃ as an activating agent. The morphology, surface chemical composition, and surface area of the as-prepared carbon materials were investigated by scanning electron microscope, X-ray photoelectron spectroscopy, and Brunauer?CEmmett?CTeller measurement, respectively. Electrochemical properties of the as-prepared sample were studied by cyclic voltammetry, galvanostatic charge/discharge, and electrochemical impedance spectroscopy measurements in 6?mol?L^?1 KOH aqueous solution. Compared with the non-activated carbon, activated carbon showed superior capacitive performance. The activation carbon presented a high specific gravimetric capacitance of 210?F?g^?1. The good electrochemical performance of the activated carbon was ascribed to well-developed micropores, high surface area, the presence of nitrogen and oxygen functional groups, and larger pore volume.     

Study on the α-cyclodextrin/poly(ethylene glycol) self-assembly supramolecular nanoparticles for drug delivery

This paper reports the synthesis and drug delivery properties of a novel supramolecular nanoparticle.α-Cyclodextrins(α-CD) were threaded on cinnamic acid modified poly(ethylene glycol) to form inclusion complex nanoparticles by supramolecular self-assemble.The anti-tumor drug doxorubicin was loaded in the nanoparticles and released in vitro to study the drug release behavior and the anti-tumor effects.The structure and morphology of the nanoparticles were characterized by nuclear magnetic resonance,X-ray di...     

鼓泡法试验薄膜力学行为的研究

本文采用弹性理论,研究了鼓泡法试验过程中,外力(P)与薄膜中心挠度(w_0)之间的本构关系,计算出P与w_0的数学表达式.该分析模型考虑了薄膜内延展变形及薄膜中残余拉应力对本构关系的影响,并在较大挠曲区间范围内(挠度为10~(-2)～10~2倍薄膜厚度)分析本构关系特征.分析结果表明,外力与薄膜中心挠度之间本构关系可表示为:P∝w_0~n,n为指数.随着薄膜中心挠度的增加,薄膜的主要力学行为由弯曲过渡到延展,本构关系由线性过渡到立方关系,本构关系方程指数n由1增加到3.利用本构方程进行数值计算结果表明,薄膜挠曲所需外力随着薄膜半径增加而减小,随着残余拉应力的增加而增加.相对于以往不考虑延展变形的小挠度模型,本文所提出的力学模型更适合于大挠度条件下鼓泡法试验.     

变角度纤维复合材料圆柱壳的轴压屈曲

变角度纤维复合材料的纤维方向角可沿铺层面内连续变化,因此相应结构的性能具有更高的设计灵活性和更大的优化空间．本文假设纤维方向角沿圆柱壳的轴向呈正弦函数变化,对变角度纤维复合材料圆柱壳在两端简支边界条件下的轴压屈曲问题进行研究．基于Donnell经典壳体理论,推导变角度纤维复合材料圆柱壳的前屈曲控制方程并运用伽辽金法进行求解,然后采用瑞利里兹法求解屈曲问题．通过和现有文献及有限元数值结果的对比,验证了本文模型的收敛性和正确性,通过数值算例分析了纤维起始角和终止角的变化对圆柱壳的屈曲临界荷载的影响．本文的研究结果可为变角度纤维复合材料圆柱壳的分析和设计提供一定的参考．     

ITER偏滤器朗缪尔探针测控系统初步设计

根据ITER诊断测控需求和控制、数据访问和通信(CODAC)设计规范,偏滤器朗缪尔探针系统使用企业建模工具(EA平台)进行仪器和控制建模设计.参照中央控制系统自动化运行和控制流程,完成了探针测控系统在等离子放电模式下运行流程的逻辑分层,具备数据采集、探针驱动电源管理、机柜健康监测、EPICS通讯等基本功能,实现了系统软...     

Ordered mesoporous platinum@graphitic carbon embedded nanophase as a highly active, stable, and methanol-tolerant oxygen reduction electrocatalyst

Highly ordered mesoporous platinum@graphitic carbon (Pt@GC) composites with well-graphitized carbon frameworks and uniformly dispersed Pt nanoparticles embedded within the carbon pore walls have been rationally designed and synthesized. In this facile method, ordered mesoporous silica impregnated with a variable amount of Pt precursor is adopted as the hard template, followed by carbon deposition through a chemical vapor deposition (CVD) process with methane as a carbon precursor. During the CVD process, in situ reduction of Pt precursor, deposition of carbon, and graphitization can be integrated into a single step. The mesostructure, porosity and Pt content in the final mesoporous Pt@GC composites can be conveniently adjusted over a wide range by controlling the initial loading amount of Pt precursor and the CVD temperature and duration. The integration of high surface area, regular mesopores, graphitic nature of the carbon walls as well as highly dispersed and spatially embedded Pt nanoparticles in the mesoporous Pt@GC composites make them excellent as highly active, extremely stable, and methanol-tolerant electrocatalysts toward the oxygen reduction reaction (ORR). A systematic study by comparing the ORR performance among several carbon supported Pt electrocatalysts suggests the overwhelmingly better performance of the mesoporous Pt@GC composites. The structural, textural, and framework properties of the mesoporous Pt@GC composites are extensively studied and strongly related to their excellent ORR performance. These materials are highly promising for fuel cell applications and the synthesis method is quite applicable for constructing mesoporous graphitized carbon materials with various embedded nanophases.     

Recent advances in enrichment techniques for trace analysis in capillary electrophoresis

CE is gaining great popularity as a well‐established separation technique for many fields such as pharmaceutical research, clinical application, environmental monitoring, and food analysis, owing to its high resolving power, rapidity, and small amount of samples and reagents required. However, the sensitivity in CE analysis is still considered as being inferior to that in HPLC analysis. Diverse enrichment methods and techniques have been increasingly developed for overcoming this issue. In this review, we summarize the recent advances in enrichment techniques containing off‐line preconcentration (sample preparation) and on‐line concentration (sample stacking) to enhancing sensitivity in CE for trace analysis over the last 5 years. Some relatively new cleanup and preconcentration methods involving the use of dispersive liquid–liquid microextraction, supercritical fluid extraction, matrix solid‐phase dispersion, etc., and the continued use and improvement of conventional SPE, have been comprehensively reviewed and proved effective preconcentration alternatives for liquid, semisolid, and solid samples. As for CE on‐line stacking, we give an overview of field amplication, sweeping, pH regulation, and transient isotachophoresis, and the coupling of multiple modes. Moreover, some limitations and comparisons related to such methods/techniques are also discussed. Finally, the combined use of various enrichment techniques and some significant attempts are proposed to further promote analytical merits in CE.     

Cr/NaZSM-5催化剂上CO2氧化丙烷脱氢反应

以亚微米级NaZSM-5为载体合成了一系列负载型Cr催化剂, 采用氮气吸附、 XRD、 UV-Vis和H2-TPR对Cr/NaZSM-5催化剂的结构和织构性质进行了表征, 并评价了催化剂在CO2气氛下的丙烷脱氢性能. 硅铝摩尔比为60, Cr质量分数为3%的催化剂具有最高的反应活性, 于550 ℃反应10 min和8 h后的丙烷转化率分别为48.3%和30.1%, 丙烯选择性则分别为86.0%和91.8%. 催化剂中的Cr6+含量和反应初活性具有良好的对应关系, 表明高Cr6+含量对催化剂表现出高的丙烷脱氢活性是至关重要的. CO2气氛下的丙烯产率明显比氮气气氛下的高, 这是由于CO2气氛下催化剂表面有较多量的Cr6+, 并且CO2可通过逆水煤气变换反应除去脱氢反应生成的氢.     

基于小分子掺杂及聚电介质模板导向的水溶性聚苯胺的CPO酶促氧化合成及结构性能表征

以氯过氧化物酶(CPO)催化H2O2氧化对苯二胺(PPD)单体,建立了一个水溶性聚苯胺(PANI)的绿色合成体系,通过添加小分子和引入模板剂导向合成目标产物,并经紫外-可见光谱、循环伏安测量、电镜扫描、热重分析及电导率测定等进行表征,结果表明,产物的各项性能均比本征态有明显改善.以高氯酸钠为掺杂剂,且n(对苯二胺)∶n(高氯酸钠)=1∶1时,产物具有明显的片层状结构,电化学活性最好,具有很强的可逆氧化还原能力;以聚苯乙烯磺酸钠(SPS)为模板剂导向合成的聚苯胺的热稳定性好,电导率高,水溶性大大增强.另外基于CPO的活性中心结构分析了PPD的聚合机理.