摘要：Lithium metal batteries (LMBs) using gelpolymer electrolytes with satisfactory theoretical capacity andlow cost hold great promise for high energy density storagesystems. However, the inherently unwanted polarizations anduncontrolled lithium dendrites resulting from inferior Li-iontransporting efficiency hinder the practical application ofconventional gel electrolytes. Herein, a highly conductivecomposite gel polymer electrolyte with effective Li-ion conducting channels is designed via swelling nanofibrous membrane, where the single-ion conducting polymer of lithiumsulfonate-based polyether (DEBS-Li) used as the Li-ion accelerator is combined with poly(vinylidene fluoride-hexafluoropropylene)P(VDF-HFP) matrix by the electrospinningtechnology. The DEBS-Li having rich sulfonic groups canpromote lithium salts dissociation via electrostatic interaction,thus expediting the ionic migration and enabling the as-developed gel electrolyte with high ionic conductivity (~1.58×10^(−3) S cm^(−1)) and lithium transference number (0.62) at 25℃.Such optimization of ionic transfer kinetics can highly delaythe nucleation time of lithium dendrite and significantly inhibit dendritic formation, which leads to a stable Li plating/stripping in the symmetrical battery over 250 h at1.5 mA cm^(−2). Benefiting from these advantages, the Li||LiFePO_(4)cell using the electrolyte realizes ultralong stable cyclingover 500 cycles at a high rate of 10 C with ~90% capacityretention. We believe this novel lithium sulfonate-basedpolyether gel polymer electrolyte has profound potential forpractical applications in high-performance LMBs.

摘要：An effective procedure for constructing a DNA biosensor is developed based on covalent immobilization of NH2 labeled,single strand DNA（NH2-ssDNA） onto a self-assembled diazo-thiourea and gold nanoparticles modified Au electrode（diazo-thiourea/GNM/Au）.Gold nano-particles expand the electrode surface area and increase the amount of immobilized thiourea and single stranded DNA（ssDNA） onto the electrode ***-thiourea film provides a surface with high conductibility for electron transfer and a bed for the covalent coupling of NH2-ssDNA onto the electrode *** immobilization and hybridization of the probe DNA on the modified electrode is studied by differential pulse voltammetry（DPV） using methylene blue（MB） as a well-known electrochemical hybridization *** linear range for the determination of complementary target ssDNA is from 9.5（±0.1） × 10^-13 mol/L to1.2（±0.2） x 10^-9 mol/L with a detection limit of 1.2（±0.1） 〉 10^-13 mol/L.

摘要：A new ion-imprinted polymer （liP） was synthesized by copolymerization of 4-vinylpyridine （monomer）, ethyleneglycoldimethacrylate （cross-linker） and 2,2-azobis-isobutyronitrile （initiator） in the presence of Cd2＋ and quinaldic acid （complexing agent）. It was found that the adsorption capacity of IIP and blank polymer were 45.0 and 6.2 mg g-l, respectively. The relative selectivity coefficients of the imprinted polymer for different binary mixture were also calculated. Compared to non-imprinted polymer （NIP）, the IIP had higher selectivity for Cd（II）. The IIP was used as a sorbent for cadmium extraction from water samples by using a simple batch extraction procedure. The effect of different parameters on Cd2＋ extraction and its recovery from the IIP were evaluated and optimized by using experimental design methodology. The optimized adsorption/desorption procedure was applied for cadmium removal from the real water samples. The obtained recoveries proved that this IIP could be used for removal of trace cadmium ions from water samples.

摘要：A novel type of molecular tweezer receptors based on deoxycholic acid has been designed and synthesized and their binding properties were examined by UV-vis spectral titration. These molecular tweezers showed a high selectivity toward F^- over Cl^-, Br^-, I^-, AcO^-, H2PO4^-.

摘要：Highly Pathogenic Avian Influenza（HPAI） H5N1 has attracted much attention as a potential pandemic virus in humans, which makes death inevitable in humans. Neuraminidase（NA） has an important role in viral replication. Thus, it is an attractive target when designing anti-influenza virus drug. However, evolving viruses cause some anti-viral drugs to be ineffective, as they show resistance to them. Selection of peptides as drug candidates is important for the peptide-receptor activity and good selectivity. Cyclic bonds in the peptide ligand design aim to improve the stability of the system and remove the obstacles in drug metabolism. The design is based on the polarity of the ligand and amino acid residues in the active site of NA. The results are 4200 cyclic pentapeptides as potential lead compounds. Docking simulations were conducted using MOE 2008.10 and were screened based on the value of the binding energy（？Gbinding）. ADME-Tox prediction assay was conducted on the selected ***- and inter-molecular interactions, as well as changes in the form of bonds, were tested by molecular dynamics simulations at temperatures of 310 K and 312 K. The results of the docking simulations and toxicity prediction assay show that there are two ligands that have a residual interaction with the target protein： CLDRC and CIWRC. These two ligands have ？Gbindingvalues of –40.5854 and –39.9721 kcal/mol（1 kcal/mol = 4.18 k J/mol）. These ligands are prone to be mutagenic and carcinogenic, and they have a good oral bioavailability. The results show that the molecular dynamics of both ligand CLDRC and CIWRC are more feasible at the temperature of 312 K. At the end,both CIWRC and CLDRC ligands can be used as the drug candidates against H5N1 virus.

摘要：目前,硫化矿是贵金属的主要来源。在硫化矿处理过程中存在的主要问题之一是其在酸中的溶解度低(K_(sp)<10^(-20)),并产生有毒有害的副产品。在本研究中,使用高锰酸铝[Al(MnO_(4))_(3)]氧化剂溶解硫化矿来提取金属,部分解决了这个问题。基于Aspen Hysys模型组装的Taguchi实验设计作为一种从实验到工业规模的新方案,已应用于Al(MnO_(4))_(3)氧化剂对硫化物矿石的溶解研究。最佳结果已被用作Aspen Hysys软件对该过程进行模拟和灵敏度分析的主要数据。研究了pH、停留温度、搅拌速率、停留时间、Al(MnO_(4))_(3)消耗量、浸出密度、粒度和氧压等参数对从硫化矿中萃取金属效率的影响。在优化条件下,锌、铜和铅的萃取率分别达到77%、73%和70%。

摘要：负载型双金属催化剂在很多催化反应中都有着十分重要的意义,包括选择性氧化、加氢/氢解、重整、生物质转化等反应。这一类催化剂的活性、选择性和稳定性取决于颗粒尺寸、组成和形貌等结构特性。针对Pd基负载型双金属催化剂体系,本文讨论了其结构特性,并探讨了不同合成方法对结构性质的调控机制。同时,本文阐述了Pd基催化剂在环境催化反应中的应用,包括CO氧化、烃类氧化、加氢脱氯和NO_x分解等反应。尽管在这些领域的研究取得了一定的进展,然而还需要更先进的催化技术来应对一些重大的挑战,如环境修复等。最近,在材料、光谱、显微、催化化学以及工程领域的研究人员的共同努力下,通过先进表征方法、机理研究手段的采用以及构效关系的研究,针对双金属催化剂设计的研究取得了一些新的进展。本篇综述旨在激励相关领域科学家设计合理的新型催化剂体系,以用于未来的绿色及可持续发展。

摘要：A highly efficient,simple,and clean single-step sonosynthetic procedure has been sophisticated for assembling new series of mono-and bis-pyridine dicarbonitriles from ketones,HCl,and *** presented protocol is applicable for the preparation of a broad range of uniquely substituted pyridine dicarbonitriles and seems to be superior in comparison with other previously reported *** antiproliferative impact of the newly synthesized derivatives was screened towards three representative cancer cell lines(MCF-7,A549,and HCT116).Most of the evaluated derivatives showed a moderate to excellent anti-proliferative activity towards the selected cell *** these,compounds 4h,4k,10,12a,and 12b showed both potent anticancer activity(ICs058μM)on non-tumorigenic cells(MCF-10A and NCM460),suggesting their promising potential to be lead molecules for future antitumor drug *** structure-activity relationships have been also ***,quantum chemical studies based on Density Functional Theory(DFT)of the synthesized compounds were investigated and found to be consistent with the in vitro inhibitory activities.

摘要：Novel stable high spin molecules possessing three different arranged fashions are designed with -·N-N〈 as a spin-containing （SC） fragment, various aromatic, such as benzene （1）, pyridine （2）, pyridazine （3）, pyrimidine （4）, pyrazine （5）, triazine （6） as end groups （EG） and phenyl as a ferromagnetic coupling （FC） unit. The effects of a different end groups on the spin multiplicities of the ground states and their stabilities were investigated by means of AM1-CI approach. It has been found that the spin densities on the two atoms of the SC fragment are different from delocalization resulting in the specific stability of -·N-N〈. In these molecules, the stabilities of the triplet states decrease when the distance between the atoms of central SC （-N-） increases. The orders of the stability of triplet states for 1an, 1bn, 1cn [They are isomers in which SC is connected with FC in different way （1an, N1NNN1; 1bn, N1N N1N; 1cn, NN1N1N） and six heterocycles are EG] show that the stability of triplet states with heterocycles as end groups is higher than that with phenyl as end groups, and in the order： triazine （EG） 〉 pyrimidine, pyrazine 〉 pyridine, pyridazine.

摘要：Novel stable high spin molecules possessing three different arranged fashions are designed with - · N-N< as a spin-containing(SC) fragment, phenylene as an end group and various aromatic molecules, such as benzene(1), 2,6-pyridine(2), 3,5-pyridine(3), pyridazine(4), 4,6-pyrimidine(5), 2,6-pyrimidine(6), pyrazine(7) and triazine(8), as a ferromagnetic coupling(FC) unit. The effects of the different coupling units on the spin multiplicities of the ground states and their stabilities were investigated by means of AM1-CI approach. It has been found that the spin densities on the two atoms of the SC fragment are different from delocalization results in the specific stability of - · N-N<. In these molecules, the stabilities of the triplet states decrease when the distance between the atoms of central SC(-N-) increases. It is shown that the heterocycles as the coupling units have influence on the stabilities of the high-spin ground states. That the heteroatom lying in m -phenyl can improve ferromagnetic coupling, while the heteroatom lying in o -phenyl or p -phenyl is not in favor of the ferromagnetic coupling.