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排序方式: 共有327条查询结果,搜索用时 15 毫秒
51.
Numerical Algorithms - This paper presents a class of low memory quasi-Newton methods with standard backtracking line search for large-scale unconstrained minimization. The methods are derived by... 相似文献
52.
G. Jeremy Leong Maxwell C. Schulze Matthew B Strand David Maloney Sarah L. Frisco Huyen N. Dinh Bryan Pivovar Ryan M. Richards 《应用有机金属化学》2014,28(1):1-17
Platinum‐based catalytic materials have received significant attention, particularly in the shape and size control of faceted materials for catalysis. More recently, there has been a rapid increase in the number of reports of successful preparations in this field; however, a fundamental understanding of controlled growth towards catalytic material design is essential for future implementation and broad application. In this review, we provide an overview of the recent findings reported since 2009, focusing on methods for shape control as well as the effects of exposed surface facets on select catalytic reactions. Copyright © 2013 John Wiley & Sons, Ltd. 相似文献
53.
Yee Soon Ling Leong Rui Lim Yoong Soon Yong Oriana Tamin Perng Yang Puah 《Natural product research》2020,34(12):1796-1803
AbstractSoft coral, Sinularia sp. had been proven to inherit promising anti-cancer properties against variety of cancer. Current study, Sinularia sp. extract was introduced to Hepatocellular carcinoma (Hep 3B). Cell viability assay indicated the extract exhibit a dose and time dependent cytotoxicity. LC50 exhibited the lowest at 72?h post treatment estimated as 45.3 µg/mL. Morphological alterations including nuclear condensation, cytoplasm shrinkage and deformed cellular shape in treated Hep 3B were observable. Chemometric analysis revealed hydrophobic metabolites were significantly altered. Elevated vitamin D and derivatives tend to up-regulation Ca2+ and ROS subsequently triggering apoptosis. Dysregulated glycerolipids may suggest that they were biotransformed to compensate the needs of phospholipids during cell damage. Perturbation of sphingolipids, ceramide and carbohydrate-conjugated ceramides species increased the release of pro-apoptotic components reside within mitochondria and promote programmed cell death in treated Hep 3B. To conclude, MS-based metabolomics enabled the characterization of Sinularia sp. extract-induced cell death. 相似文献
54.
The iridium complex [Cp1IrCl2]2 is a good catalyst for the directed oxidative coupling of arenes with alkenes; a wide range of carbonyl functionalities (NHCOR, CONH2 and COR) can be employed as the directing group. 相似文献
55.
We demonstrate mass-producible, mobile, self-loading microcontainers that can be used to encapsulate both non-living and living objects, thus forming three-dimensionally patterned, mobile microwells. 相似文献
56.
The interaction between the osmium clusters [Os3(CO)12], [Os3(CO)10(mu-H)2], [Os3(CO)10(mu-H)(mu-OH)], and a series containing a free functional group, viz., [Os3(CO)10(mu-H)(mu-S--EH)] (where -- =alkylwedge chain or an aromatic ring, E=COO, S or O), with SiO2, ZnO and In2O3, was examined by ToF-SIMS and IR spectroscopy. While the interaction with the silica surface is mostly via an O atom or the functional group, the interaction with the ZnO and In2O3 surfaces is more complex. 相似文献
57.
Dr. Shi Xuan Leong Dr. Ya-Chuan Kao Dr. Xuemei Han Dr. Zhong Wei Poh Jaslyn Ru Ting Chen Emily Xi Tan Yong Xiang Leong Dr. Yih Hong Lee Dr. Wei Xuan Teo Prof. George W. Yip Prof. Yulin Lam Prof. Xing Yi Ling 《Angewandte Chemie (International ed. in English)》2023,62(44):e202309610
Molecular recognition of complex isomeric biomolecules remains challenging in surface-enhanced Raman scattering (SERS) spectroscopy due to their small Raman cross-sections and/or poor surface affinities. To date, the use of molecular probes has achieved excellent molecular sensitivities but still suffers from poor spectral specificity. Here, we induce “charge and geometry complementarity” between probe and analyte as a key strategy to achieve high spectral specificity for effective SERS molecular recognition of structural analogues. We employ 4-mercaptopyridine (MPY) as the probe, and chondroitin sulfate (CS) disaccharides with isomeric sulfation patterns as our proof-of-concept study. Our experimental and in silico studies reveal that “charge and geometry complementarity” between MPY's binding pocket and the CS sulfation patterns drives the formation of site-specific, multidentate interactions at the respective CS isomerism sites, which “locks” each CS in its analogue-specific complex geometry, akin to molecular docking events. Leveraging the resultant spectral fingerprints, we achieve > 97 % classification accuracy for 4 CSs and 5 potential structural interferences, as well as attain multiplex CS quantification with < 3 % prediction error. These insights could enable practical SERS differentiation of biologically important isomers to meet the burgeoning demand for fast-responding applications across various fields such as biodiagnostics, food and environmental surveillance. 相似文献
58.
Pyrolysis of the organometallic polymer [Ru(CO) 4] infinity affords metallic ruthenium nanofibers. The molecular structure, especially the presence of metal-metal bonds, appears to direct the aggregation of the metal atom chains upon loss of the carbonyl ligands. 相似文献
59.
Di Liu Jia Zhao Youchao Kong Haoqiang Ai Haoyun Bai Chon Chio Leong Kin Ho Lo Shuangpeng Wang Weng Fai Ip Sen Lin Hui Pan 《Chemphyschem》2023,24(11):e202200937
Carbon neutrality has drawn increasing attention for realizing the carbon cyclization and reducing the greenhouse effect. Although the C1 products, such as CO, can be achieved with a high Faraday efficiency, the targeted production of C2 fuels as well as the mechanism have not been systematically investigated. In this work, we carry out a first-principles study to screen dual-atom catalysts (DACs) for producing C2 fuels through the electrocatalytic carbon monoxide reduction reaction (e-CORR). We find that methanol, ethanol and ethylene can be produced on both DAC−Co and DAC−Cu, while acetate can be achieved on DAC−Cu only. Importantly, methanol and ethylene are preferred on DAC−Co, while acetate and ethylene on DAC−Cu. Furthermore, we show that the explicit solvent can enhance the adsorption and influence the protonation steps, which subsequently affects the protonation and dimerization behavior as well as the performance and selectivity of e-CORR on DACs. We further demonstrate that the C−C coupling is easy to be formed and stabilized if the Integrated Crystal Orbital Hamilton Population (ICOHP) is low because of the low energy barrier. Our findings provide not only guidance on the design of novel catalysts for e-CORR, but an insightful understanding on the reduction mechanism. 相似文献
60.