冷带轧机液压厚控系统动态数学模型分析与测试

分析了液压厚度控制系统动态数学模型．并与频率特性测试仪所测结果做了比较．得出了实用的被控对象结构图．为厚度控制系统的设计提供了理论依据．     

一种高质量的2 kb/s语言编码算法MWI

提出一种高质量的低速率语言编码算法ＭＷＩ,该算法对传统的波形插值算法ＷＩ进行了全面的改进。ＭＷＩ采用了一种更加合理的插值模型,包括统一的清音和浊音分析合成模型、新的典型波形的提取和表示方法,并且采用动态规划的算法增加基音周期估计的准确性。由于不依赖于准确的清浊音判别,ＭＷＩ具有更强的抗噪声能力。ＭＷＩ的参数设置也有利于更加有效的参数量化。随着编码速率的下降,ＭＷＩ的质量虽然呈下降的趋势,但在２ｋｂ／ｓ的速率下,它仍然能给出具有很高清晰度和自然度的合成语音。构造的完整的ＭＷＩ２ｋｂ／ｓ的声码器,具有很高的自然度和可懂度。     

用于语音识别中的SOFM矢量量化方法

该文讨论了神经网络语音识别系统中的ＫｏｈｏｎｅｎＳＯＦＭ神经网络的矢量量化（ＶＱ）的原理与过程,着重解决了其在实际应用时的若干问题,包括网络大小,学习步幅函数以及矢量量化过程中的公平竞争学习的控制函数的选定。过讨论了基于听觉模型的声学特性的提取与处理,这与ＶＱ性能息息相关。系统应用的实验表明,该神经网络在语音识别系统中具有良好性能。     

Recognition of guests bearing donor and acceptor hydrogen bonding groups by heteroditopic calix[4]arene receptors

The synthesis of new hosts specifically designed for the recognition of neutral guests bearing donor-acceptor hydrogen bonding groups is described. These hosts are characterized by the presence of two distinct binding region in close proximity: the rigid π-donor cavity and the H-bond donor N-methylene-N′-phenylureido group inserted onto the upper rim of the calix[4]arene skeleton. The binding abilities of these receptors were investigated toward a series of neutral ditopic organic molecules in CDCl₃ solution by ¹H NMR spectroscopy. The results obtained show that rigidity of the calix[4]arene apolar cavity is the control element in determining efficiency. In fact, compared with the more rigid 2, host 10, where the rigidity of the cone structure is maintained by hydrogen bonding of the OH of the lower rim, a decrease of efficiency of almost one order of magnitude was observed. The cooperative effect of the two binding region of host 2 was verified with different classes of ditopic guests. Good efficiency in the recognition of urea derivatives and dimethylsulfoxide was achieved.     

三维主体分子的合成及阴离子识别研究进展

生物功能体系的模拟是生物有机化学和超分子化学发展的前沿领域之一。本文简要论述新型大二环．大三环、笼型环番以及其它三维主体分子的合成及对阴离子选择性识别作用的研究新进展。     

Molecular Recognition and Crystal Energy Landscapes: An X‐ray and Computational Study of Caffeine and Other Methylxanthines

We introduce a new approach to crystal‐packing analysis, based on the study of mutual recognition modes of entire molecules or of molecular moieties, rather than a search for selected atom–atom contacts, and on the study of crystal energy landscapes over many computer‐generated polymorphs, rather than a quest for the one most stable crystal structure. The computational tools for this task are a polymorph generator and the PIXEL density sums method for the calculation of intermolecular energies. From this perspective, the molecular recognition, crystal packing, and solid‐state phase behavior of caffeine and several methylxanthines (purine‐2,6‐diones) have been analyzed. Many possible crystal structures for anhydrous caffeine have been generated by computer simulation, and the most stable among them is a thermodynamic, ordered equivalent of the disordered phase, revealed by powder X‐ray crystallography. Molecular recognition energies between two caffeine molecules or between caffeine and water have been calculated, and the results reveal the largely predominant mode to be the stacking of parallel caffeine molecules, an intermediately favorable caffeine–water interaction, and many other equivalent energy minima for lateral interactions of much less stabilization power. This last indetermination helps to explain why caffeine does not crystallize easily into an ordered anhydrous structure. In contrast, the mono‐ and dimethylxanthines (theophylline, theobromine, and the 1,7‐isomer, for which we present a single‐crystal X‐ray study and a lattice energy landscape) do crystallize in anhydrous form thanks to the formation of lateral hydrogen bonds.     

计算机模式识别法对甲状腺机能亢进症微量元素谱的研究

据Mahlanobis距离判别法，利用计算机多元统计判别程序，对14例甲亢思者和21例健康人的血清中锌、铁、铜、锰、镁和锶等元素浓度差异进行分类判别研究。选择锌、铁、钙、锶作判别特征参量时，患者和健康人的分类准确率为100％，服碘前与服碘后的甲亢患者分类准确率为92.7％，分类研究指出，甲亢患者血清中的铁和锶浓度高于健康人，经服碘治疗后，患者血清中上述元素浓度降低与健康人相近。     

Visual recognition of melamine in milk via selective metallo-hydrogel formation

A novel protocol allowing convenient and highly selective visual recognition of melamine in raw milk via selective metallo-hydrogel formation at a concentration as low as 10 ppm without any tedious pretreatment has been developed.     

New chemosensor for larger guests based on modified cyclodextrin bearing seven hydrophobic chains each with a hydrophilic end group

A new chemosensor for larger guests was prepared. The new chemosensor bears hydrophobic units at the primary hydroxy side and a dansyl unit at the secondary hydroxy side of β-cyclodextrin. Due to the hydrophobic units, the new chemosensor is sensitive to large or slender guests such as SDS and insensitive to 1-adamantanol, which is a good guest for the natural β-CD.     

Crystal Structures of 1,5,9,18,22,26-Hexaaza[11.11]-p-cyclophane Adducts; Two-dimensional Supramolecular Networks

Two newly identified supramolecular structures arise from self-assembly of the macrocyclic 1,5,9,18,22,26- hexaaza[11.11]-p-cyclophane salts with o-nitrophenol (C₂₈H₅₀N₆)⁴⁺·4(C₆H₄NO₂O)⁻ (1) and with HCl (C₂₈H₅₂N₆)⁶⁺·6Cl^-·4H₂O (2). In both cases two-dimensional supramolecular sheets are formed.