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3-单酰胺喹唑啉酮衍生物的表征及密度泛函理论研究(英文)
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作者 AL-SEHEMI Abdullah G. Al-AMRI Reem S.Abdulaziz irfan ahmad 《物理化学学报》 SCIE CAS CSCD 北大核心 2013年第1期55-63,共9页
Several 3-aminoquinazolin-4-(3H)-one derivatives were synthesized and characterized.Using proton nuclear magnetic resonance (NMR) spectra,we have investigated the barriers to rotation around the N ― N bond as a funct... Several 3-aminoquinazolin-4-(3H)-one derivatives were synthesized and characterized.Using proton nuclear magnetic resonance (NMR) spectra,we have investigated the barriers to rotation around the N ― N bond as a function of temperature.Changes in the NMR spectra at high temperatures are explained in terms of hindered rotations of the N ― N bond.Free energies of activation for the rate determining stereochemical process were calculated to be as high as 67-75 kJ · mol-1.Ground state molecular geometries and vibrational frequencies were calculated using the HF/6-31G and B3LYP/6-31G level of theories.The optimized bond lengths and bond angles are in good agreement with experimental values at both theoretical levels. 展开更多
关键词 振动频率 衍生物 化学分析 活化自由能
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Arabic Bank Check Processing: State of the Art
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作者 irfan ahmad Sabri A.Mahmoud 《Journal of Computer Science & Technology》 SCIE EI CSCD 2013年第2期285-299,共15页
In this paper, we present a general model for Arabic bank check processing indicating the major phases of a check processing system. We then survey the available databases for Arabic bank check processing research. Th... In this paper, we present a general model for Arabic bank check processing indicating the major phases of a check processing system. We then survey the available databases for Arabic bank check processing research. The state of the art in the different phases of Arabic bank check processing is surveyed (i.e., pre-processing, check analysis and segmentation, features extraction, and legal and courtesy amounts recognition). The open issues for future research are stated and areas that need improvements are presented. To the best of our knowledge, it is the first survey of Arabic bank check processing. 展开更多
关键词 handwriting analysis document analysis text processing feature evaluation and selection pattern analysis
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