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71.
Chemical and physical analyses of malt, the main ingredient of beer, have been used to predict the concentration of certain volatile compounds in the finished beer.The prediction was done by means of the partial least squares regression (PLS2) in SIMCA. The total data set as well as individual malt clusters were submitted to PLS analysis. Best prediction was obtained by separating the total object matrix in classes according to similarity found by fuzzy pattern recognition (FCV). FCV was also used to separate the beer variables in classes and to select the subset of variables to be predicted.A joint approach of fuzzy pattern recognition to identify groups of samples and SIMCA-PLS2 to predict several dependent variables is suggested as a powerful tool in process-analytical chemistry. 相似文献
72.
Bile acid-based acyclic receptors bearing two imidazole and benzimidazole moieties have been synthesized. Anion binding studies using 1H NMR revealed that imidazolium receptor exhibits high selectivity for chloride ion while benzimidazolium receptor showed selectivity for Y-shaped acetate ion through hydrogen bond interactions involving imidazolium C-2 and acetyl methylene hydrogens. 相似文献
73.
74.
Lämmerhofer M 《Journal of chromatography. A》2005,1068(1):31-57
A review on the advantages, peculiarities, and the potential of enantioselective capillary electrochromatography (CEC) in nonaqueous media is presented. Some fundamentals on CEC with particular focus on enantioselective CEC are discussed. The strategies, concepts, preferentially utilized chiral selectors and column technologies that have been utilized to succeed in highly efficient enantiomer separations by nonaqueous CEC are described thoroughly. 相似文献
75.
76.
本文报道新的Tweezer(1)的合成,用^1HNMR研究了新的Tweezer分子和对硝基苯甲酸盐的配位效应,结果表明它兴通过氢键,静电引力和芳环夹心堆叠作用而自动缔合。 相似文献
77.
以表没食子儿茶素没食子酸酯(Epigallocatechin-gallate,EGCG)为模板分子,α-甲基丙烯酸为功能单体,乙二醇二甲基丙烯酸酯为交联剂,在光冷引发条件下合成EGCG分子印迹聚合物,利用该聚合物制成分子印迹固相萃取柱,用于固相萃取茶叶提取物茶多酚,对萃取柱中的清洗液、洗脱剂、上载量等进行了选择.结果表明,在萃取柱上载样品之后,先用V(甲醇):V(水)=1:9溶液进行清洗,再用V(甲醇):V(乙酸)=9:1混合液进行目标分子的洗脱,可以得到比较纯的目标物质EGCG(色谱峰相对峰面积达92.4%),萃取柱在上载样品并进行清洗、洗脱之后,EGCG的回收率达69.3%.分子印迹柱具有较好的稳定性和耐用性能,使用20次后其选择性识别能力仍未降低,但空白印迹柱却没有这样的选择性识别能力. 相似文献
78.
Direct CI mass spectrometry profiling of fatty acid methyl esters (FAMEs) from in situ thermal hydrolysis/methylation (THM) of whole bacterial cells with tetramethylammonium hydroxide (TMAH) has been demonstrated as a potential method for real time and fieldable detection/identification of microorganisms. Bacillus anthracis (Ames), Yersinia pestis (Nair. Kenya), Vibrio cholerae (E1 Tor), Brucella melitensis (Abortus wild) and Francisella tularensis (LVS vaccine) were profiled by this method during a 10-month period. Repeatability of the in situ FAME data was calculated using one-way analysis of variance (ANOVA) and a t-test. Artificial neural network (ANN) and multivariate statistics of the FAME profiles were also compared for bacterial identification/classification. Equivalent results were obtained with a multivariate rule building expert system (MuRES) and the ANN. However, the ANN analysis required much less computer time and was deemed the best choice for this application. In situ THM FAME profiles of the bacterial samples provided comparable results with those obtained from the Microbial Identification System (MIDI) (Newark, DE) wet chemistry-gas chromatographic based system. 相似文献
79.
Hiroyuki Asanuma Sumie Gotoh Takeshi Ban Makoto Komiyama 《Journal of inclusion phenomena and macrocyclic chemistry》1997,27(3):259-264
Poly(2-vinyl-4,6-diamino-1,3,5-triazine) efficiently binds nucleic acid bases and nucleosides in water by using complementary hydrogen bonding. The binding activity decreases in the order: U, T > A C, G. The corresponding monomer shows virtually no activity, indicating a predominant role of polymer effect for the molecular recognition in water. 相似文献
80.
Kubo T Hosoya K Nomachi M Tanaka N Kaya K 《Analytical and bioanalytical chemistry》2005,382(7):1698-1701
A molecularly imprinted polymer was prepared using a water-soluble crosslinking agent. An ionic complex was utilized as the assembly for the template molecule and the functional monomer, and water as porogenic solvent during preparation of the imprinted polymer. The results of chromatographic evaluations for the prepared polymer suggested that the polymer had much lower hydrophobicity compared with usual octadecyl group bonded silica or the usual molecular imprinted polymer prepared from ethyleneglycol dimethacrylate, and the selective recognition ability for template molecule in the completely aqueous condition. 相似文献