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11.
Eric Gifford Mark Johnson Chun-che Tsai 《Journal of computer-aided molecular design》1991,5(4):303-322
Summary The metabolic pathways of medazepam, oxazepam, and diazepam were modeled using graph-theoretic transforms which are incorporable into computer-assisted metabolic analysis programs. The information, represented in the form of a graph-theoretic transform kit, which was obtained from these pathways was then used to predict the metabolites of other benzodiazepine compounds. The transform kits gave statistically significant predictions with respect to a statistical method for evaluating the performance of the transform kits. 相似文献
12.
基于BP神经网络的企业未来获利能力智能综合评价 总被引:3,自引:0,他引:3
分析了相关分析——多指标综合评价法在确定企业未来获利能力方面的优点和不足 ;并在其基础上提出了基于 BP神经网络的多指标综合评价法 ;仿真试验证明了基于 BP神经网络的多指标综合评价法的有效性 相似文献
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The electrocatalytic oxidation of 2-propanol was investigated using on line differential electrochemical mass spectrometry (DEMS) on electrodeposited Pt and an arrange of bimetallics: Pt0.84Rh0.16, Pt0.70Rh0.30, Pt0.55Rh0.45. It has been observed that the Pt0.84Rh0.16 bimetallic electrode presented the best catalytic activity for 2-propanol electrochemical oxidation. Since 2-propanol is a secondary alcohol, only acetone and CO2 are produced. The total yield of CO2 and acetone has been determined from the DEMS measurements. It is found that acetone is the major product, as reported before for other electrodes. The acetone and CO2 yield depends on the electrode composition. High amount of rhodium in the electrode composition strongly diminish the reaction rate as indicated by the decrease of both the acetone and CO2 yield. However, acetone inhibition is much more intense. The only bimetallic electrode that presents considerable mass spectroscopy signals intensity for CO2 and acetone is the Pt0.84Rh0.16 electrode. This electrode shows a slight increase in CO2 selectivity, compared to the other electrodes studied in this work. Only very low coverages of stable adsorbates were present during the reaction. Two and one carbon adsorbate were observed for all the electrodes. Three carbon adsorbates were detected only for the Pt0.84Rh0.16 electrode. Therefore, acetone production does not require a stable adsorbate. 相似文献
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第二讲合成孔径声纳成像及其研究进展 总被引:1,自引:0,他引:1
文章在介绍了图像声纳的特点、合成孔径声纳(synthetic aperture sonar,SAS)产生背景和发展过程的基础上,对合成孔径声纳的原理、技术难点、成像算法等问题进行了讨论.着重分析了合成孔径声纳成像过程中高分辨率的获取方法、水声信道对成像的影响、多子阵技术及其成像算法、稳定的声纳运动平台和运动监测问题、运动补偿与自聚焦方法等.文章还给出了国内外合成孔径声纳研究的最新进展情况,进而展望了合成孔径声纳的应用前景. 相似文献
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7-氮杂-3,6-二氧杂-二环[3.3.0]辛-2-酮类化合物合成的新方法 总被引:1,自引:0,他引:1
5-甲氧基-2-(5H)-呋喃酮与氮酸硅烷基酯通过1,3-偶极环加成反应可以为7-氮杂-4-甲氧基-3,6-二氧杂-二环[3.3.0]辛-2-酮类化合物提供新的合成途径。通过元素分析、IR、^1HNMR、^13CNMR、MS等波谱分析进行了结构表征。 相似文献
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甾醇资源的利用和皮质激素侧链的合成方法 总被引:1,自引:0,他引:1
本文讨论了开发甾醇资源作为甾体药物合成原料的前景,并综述了近几年由17-酮基甾体合成皮质激素侧链的各种方法。 相似文献
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The synthesis of malachite CuCO3·Cu(OH)2 or Cu2CO3(OH)2 was studied through titrations of copper(II) salt solutions with a solution of sodium carbonate at different temperatures. The precipitates were characterized by TG, IR and chemical analysis. The composition varies depending on thepH of the solution and the temperature. Purer malachite was synthesized by simple mixing of a solution of copper(II) nitrate or sulfate with a solution of sodium carbonate at 50°C.The kinetics of the thermal decomposition of synthetic malachite was described by eitherR
3 orA
m(m=1.2–1.4) law, according to TG analysis, both isothermal and nonisothermal. The Arrhenius parameters determined using three different integral methods showed the kinetic compensation effect, which is correlated to the working temperature interval analyzed.The authors thank Mr. H. Takemoto for analyzing kinetics of the thermal decomposition of synthetic malachite. 相似文献
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The polarographic behaviour of uranium and tellurium has been studied in the presence of increasing concentration of complex forming agent viz. ?-caprolactam at pH 4.4 for U(VI) and at pH 10.0 for Te(IV) at μ=0.1 M KNO3. In both cases the waves have been found to be diffusion controlled and irreversible. The values of kinetic parameters (σπa and K°f,h) have been calculated as a function of the ligand concentration. Method is suitable for the quantitative determination of these metals individually and simultaneously with the effect of diverse ions. 相似文献