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The charge-remote fragmentation of protonated alkylamines and the fragmentation of alkylamine ions can be explaned by using the radical mechanism and hydrogen abstraction of intramolecule, respectively.

自由基机理可以解释质子化脂肪胺分子的远电荷反应。分子内氢抽取可以解释脂肪胺分子离子的碎裂反应。

Structures of Na~+-AD ion-complexes with 1 or 2 H2O molecules were obtained. It was found that H2O can bond with Na~+ in the structure of Na~+-AD to form Na-O van der Waals bond. H2O molecule can also bond with N or O atoms in AD moiety to form H-bonds as N-H…Ow or O…Hw-Ow. The former process takes place more easily. The most stable structures of Na~+-AD ion-complexes with 1 and 2 H2O molecules are W-C7AB and 2W-C7AB, respectively.αB conformer of Na~+-AD can not exist in the presence of 2 H2O molecules.

研究发现水分子可以结合在Na~+-AD络合离子中的Na~+附近形成Na-OW范德华键，也可以与Na~+-AD络合离子骨架结构中电负性较强的N或O原子结合形成N-H…OW或O…HW-OW氢键，相对而言，水分子更容易结合在Na~+-AD络合离子中的Na~+位置，Na~+-AD最稳定的带1个或2个水分子的结构分别为W-C7AB和2W-C7AB，Na~+-AD络合离子的αB构象在2分子水存在的情况下完全消失。

The excited and emission spectra of anthrone derivative, lactoflavin and chlorophyll a in different solvents are taken and the fluorescence yields has been estimated. The results show that the emission spectrum depends on the structure of molecule, and shifts to red with increasing of number of π electrons in the molecule.It is...

本文通过考察三种具有不同π电子数的有机共轭分子在不同溶液中的光谱特性，观察其激发光谱和发射光谱的变化情况，比较同一分子在不同溶液中的荧光量子产率，并通过对各类有机共轭分子溶液的光谱分析比较，以获得有机共轭分子的发光受溶剂影响以及同一溶液中不同有机共轭分子间发生非辐射共振能量转移的信息。

Through the Raman experiment data obtained above, the order parameters were determined and the orientation distribution graphs of BY and MO in BSFs were given. BY molecules were mainly oriented towards the plane of BSFs, but there was some probability towards other directions. The phase transition of the BSF from gel-to-liquid crystal resulted in a decrease of orientation distribution along the plane of the BSF and a increase diverging from the plane.

BY分子主要沿90°方向取向，但其它方向亦有一定的取向几率；MO分子的取向分布对BSF相变的反映是其有序程度的变化，BSF从凝胶态到液晶态的相变导致MO分子沿90°方向取向几率减小，而沿其它方向的取向几率增加，这实际对应MO分子热运动程度的增加。

The evolution of the self-organization structure for multicomponent systems containing amphiphilic moleculae. We have gotten the rule about effects of the construction of the surfactant molecula and the interaction strengths among the surfactant, oil and water moleculae on the self-organization structure after the phase separation.

研究含有双亲分子的多元系统的自组织结构演化规律，得到表面活性剂分子与水、油分子的相互作用强度以及表面活性分子的构形对分离成的自组织结构的影响规律。

The relative stabilities and probable proton transfer in isolated and monohydrated 2-hydroxyimidazole molecules have been studied in gas phase using ab initio (MP2/6-31＋G *) method.

采用从头算方法在MP2/6-31＋G*水平上研究了2-羟基咪唑分子在孤立分子和一水合物的异构体的相对稳定性和可能的质子迁移反应，分析了一个水分子的参与对2-羟基咪唑分子异构体的相对稳定性和质子迁移速率的影响，采用Monte Carlo模拟方法研究了反应体系在水溶液中反应的溶剂化效应。

But the conventional CoM FA exists some defects, including the selection of potential function of molecular field, the determination of bioactive conformers, the molecular alignment and the selection of variable of molecular fields, etc.

但传统的比较分子场分析方法在具体的实现过程中还存在着一些缺陷和不足，包括分子场势能函数的选择，活性构象的确定，分子的叠合以及分子场变量的选取等等。

Spin-coating thin film has many aggregations and pinholes on its surface, TSPP LB films showed a relatively more flattened and condensed surface. The TSPP macrocycle lied vertical to the surface of the substrate, the long alkyl chains of the TSPP were not straight but lay on the substrate with a tilted angle about 52.3°.

在旋转涂得的薄膜上，TSPP分子以聚集体的形式分散分布，未聚集的TSPP分子形成的薄膜表面分布着大量针孔状的缺陷；LB膜表面平整均匀，TSPP分子的环平面紧密地排列在一起以羧基为支撑点垂直&站立&在基片平面上，分子侧链与基片平面成52.3°角排列。

We provide a brief survey of recent results on the electronic transport characteristics of single molecules as well as self-assembled monolayers.

摘要介绍了测量单个有机分子导电性质的一些进展，包括分子的尺寸效应、官能团效应、分子与电极的接触效应等，以及分子逻辑器件的初步研究。

We also use rank sum test to analyse the differe- nce between the light pre-eclampsia group and the severe pre-eclampsia group (P=0.000),the early onset pre-eclampsia group and the late onset pre-eclampsia group (P=0.003). All of the results give the same conclude that the differences within the three groups are significant (P.05). Conclusion: We conclude that HLA-G proteins are normally expressed in invasive trophoblasts and HLA-G proteins expression is defective in most pre-eclamptic placenta.We propose that trophoblasts lacking HLA-G proteins are vulnerable to attack by the maternal immune system.

结论HLA-G分子特异性分布于胎盘EVCT的胞膜及胞浆中，生理妊娠组、子痫前期组间差异性存在表明其表达量的下降与子痫前期的发病相关；轻、重度子痫前期组间显著差异表明HLA-G分子表达量的下降与子痫前期病情严重程度相关，早发型重度子痫前期患者胎盘组织中HLA-G分子的表达明显低于迟发型组，提示我们HLA-G分子表达的降低程度还与发病早晚有关。

The labia have now been sutured together almost completely.The drains and the Foley catheter come out at the top.

此刻阴唇已经几乎完全的缝在一起了，排除多余淤血体液的管子和Foley导管从顶端冒出来。

To get the business done, I suggest we split the difference in price.

为了做成这笔生意，我建议我们在价格上大家各让一半。