电导法研究环己烷/水/CTAB乳状液的稳定性

制备了不同组成的环己彬水／十六烷基三甲基溴化铵（CTAB）乳状液,用电导法测定了正己醇、聚乙二醇等添加剂存在下乳状液富水相不同时间的电导率、通过提出增比电导率Kr的新概念,描绘了dkr／dt与时间的关系曲线,并由dkr／dt—t曲线求得了该曲线上的极值点tmax和（dkr／dt）max,定量判断了乳状液的稳定性,结果与分相法观察到油水分层的时间tp基本吻合。     

大型数据库中的高效序列模式增量式更新算法

提出一种称为FIMS（fast incremental mining of sequential patterns)的序列模式增量式更新算法，处理因数据库的更新而引起的序列模式的维护问题。主要思想是利用原先的序列模式挖掘结果，通过建立一个投影数据库来减少对整个数据库的扫描次数和侯选序列的生成，从而提高挖掘的效率。实验结果显示在更新数据量远小于整个数据库的大小时，FIMS算法的性能优于GSP算法4－7倍。     

Experimental investigation of incremental reactivity of di-tert-butyl peroxide

Large quantities of di-tert-butyl peroxide (DTBP) have been emitted into the troposphere due to human activities. Its role in the atmospheric photochemical reaction has not been understood. This study presents the results of the photochemical reactions of DTBP and NOx, which have been simulated in a self-made smog chamber under the temperature of (29±1)℃. Both the wall decays of ozone and NO2 could be neglected, compared to the results in simulative experiments. The effective intensity of UV light used in the experiments was 1.28×10-3 s-1, which was expressed by the rate constant of NO2 photolysis in purified air. The reaction mechanism was proposed according to our results and reports of other researchers. The maximum values of incremental reactivity (IR) in the three simulative ex- periments were 9.53×10-2, 5.23×10-2 and 3.78×10-2, respectively. The incremental reactivity decreased with the increase of initial concentrations of DTBP. The IR value of DTBP obtained in this study was comparable to that of acetylene reported in our previous research.     

关联规则挖掘算法及其在冷轧生产中的应用

针对Apriori算法在实际应用中无法发现关联规则变化趋势的问题,该文根据增量挖掘算法的优点对Apriori算法进行了改进。改进的Apriori算法能够在原算法的基础上,通过关联规则统计量的变化确定强规则与候选规则之间的转换,从而进一步发现关联规则的变化趋势,提高了依靠Apriori算法得到的关联规则对决策分析支持的可靠性。将改进算法应用于冷轧生产过程预测中,试验结果表明,改进算法相对于传统的Apriori算法对产量预测的精度提高了30%。     

电液伺服阀在三维数控弯管系统中的应用研究

电液伺服阀的控制是数控弯管机控制系统中的关键;通过利用增量式PID控制方法,采用工业控制计算机、计数器/定时器及数模转换器,实现了对电液伺服阀的准确控制。在实际应用中弯管质量和重复精度高,完全能够满足生产要求。     

参数自整定模糊PID控制器的设计与仿真

为保证大时滞复杂系统的稳定性和抗干扰性,结合模糊控制和常规PID控制的优点,设计了一种参数自整定模糊PID控制器,根据其输出形式的不同,采用了位置式和增量式2种方法对时滞系统进行了有效控制,利用Matlab软件的Simulink和Fuzzy工具箱进行了仿真．结果表明：增量式输出方法时控制效果更好,并具有零超调、无静差、过渡时间短、稳定性好等特点．根据实验结果,总结出了调整模糊PID控制器各参数的一般规律和设计方法．     

发电偏离电量的网损影响

运用发电偏离电量与网损分配的数学模型,通过特定电网对电量偏离的特征和影响进行了计算与分析.由于电源点离负荷中心的电气距离不同,形成了两种典型的发电偏离电量网损微增特性.按照发电偏离电量对电网运行的影响,提出了3种偏离程度的认定与划分判据.此方案已被电力部门采纳,经实际运行,证明是切实可行的.     

Protein Secondary Structure Prediction with Partially Recurrent Neural Networks

Abstract

Partially recurrent neural networks with different topologies are applied for secondary structure prediction of proteins. The state of some activations in the network is available after a pattern presentation via feedback connections as additional input during the processing of the next pattern in a sequence. A reference data set containing 91 proteins in the training set and 15 non-homologous proteins in the test set is used for training and testing a network with a modified, hierarchical Elman architecture. The network predicts the secondary structures α-helix, β-sheet, and “coil” for each amino acid. The percentage of correctly classified amino acids is 67.83% on the training set and 63.98% on the test set. The best performance of a three-layer feedforward network is 62.7% on the same test set. A cascaded network, where the outputs of the recurrent network are processed by a second net with 13 × 3 inputs, four hidden and three output units has a predictive performance of 64.49%. The best corresponding feedforward net has a performance of 64.3%.     

Conformational searching using a population-based incremental learning algorithm

A new population-based incremental learning algorithm for conformational searching of molecules is presented. This algorithm is particularly effective at determining, by relatively small number of energy minimizations, global energy minima of large flexible molecules. The algorithm is also able to find a large set of low energy conformations of more rigid small molecules. The performance of the algorithm is relation to other algorithm is examined via the test molecules: C(18) H(38) , C(39)H(80) , cycloheptadecane and a set of five drug-like molecules.     

烟雾箱模拟丙烯-NOx的大气光化学反应

利用自制烟雾箱对丙烯-NO_x的光化学反应进行了一系列模拟实验, 研究了相对湿度及丙烯与NO_x的初始浓度比值对丙烯-NO_x光化学反应产物如O₃和CO的影响. 实验得到了臭氧最大值、CO最大值及反应掉的C₃H₆均随相对湿度的增加而减少, 丙烯的臭氧生成活性最大值(IR_max)也随着相对湿度的增加而减小, 且两者间存在显著的线性关系. 丙烯与NO_x的比值对反应生成臭氧最大值的影响出现两种情况: 当初始浓度比值在1.0～3.4之间时, 臭氧最大值随着该比值的增加而有大幅度提高|而当该比值分别在3.7～7.4之间时, 臭氧最大值随比值的增加而有小幅度的下降. 此外, 本研究还利用丙烯MCMv3.1机理对反应进行了数值模拟.