Quantum chemical studies on protonation of some substituted thiazole derivatives

The acidity constants, pK(a) values for protonation of some substituted thiazole derivatives were calculated by using AM1 and PM3 basis sets of semi-empirical methods and B3LYP/6-31G(d) basis sets of density functional theory (DFT) calculated physical and thermodynamic parameters. Correlation search among the experimental and calculated acidity constants, pK(a) values, revealed that the best correlation exist between the experimental and ab initio calculated pK(a) values with a regression of R(2)=0.98.     

Efficient storage of healthcare data in XML-based smart cards

In this paper we present storage structures for efficiently processing XML path queries on healthcare data stored in smart cards using XML format. In the design of the storage structures that we present, properties of healthcare data and fundamental types of queries on the healthcare data are taken into account as well as the constraints of the smart cards. We compare the space and time efficiency of the proposed storage structures for various types of queries.     

近红外光谱法测定烷烃分子的拓扑指数

利用近红外光谱法测定了烷烃分子的分子连接指数 ,并探讨了混合烃分子连接指数与单烃分子连接指数之间的关系。结果表明 :单烷烃分子连接指数具有可测性 ,而混合烃分子连接指数与单烃的分子连接指数之间存在线性加和的关系     

基于COM与N层B/S结构的SNMP网管研究与实现*

分析了传统单一C/S结构的不足以及新型N层B/S结构的优越性,阐述了基于Web技术的网络管理是未来网络管理的发展趋势,结合现代软件开发中的软件复用理论,提出并设计实现了一种基于COM技术与N层B/S结构的SNMP网管系统模型,着重叙述了该系统中所使用的关键技术与设计要点。     

快速移植的微型呼叫中心设计

介绍了如何构建微型呼叫中心的系统设计及组成,给出了相应的系统结构,并对微型呼叫中心核心部分的设计进行了描述。该设计方案的优点是投资少,软件开发和扩展均较容易,实施快速,特别适合接入线路不多的微型呼叫中心。     

Query Processing Techniques for Multimedia Presentations

A multimedia presentation is a synchronized, and possibly interactive, delivery of multimedia data to users. We expect that, in the future, multimedia presentations will be stored into and queried from multimedia databases. In an earlier work, we have designed a graphical query language, called GVISUAL, that allows users to query multimedia presentations based on content information. In this paper, we discuss GVISUAL query processing techniques for multimedia presentations. More specifically, we discuss the translation of GVISUAL queries into an operator-based language, called O-Algebra, with three new operators, and efficient implementations of the new O-Algebra operators using a coding system called nodecodes.     

Clustering of high throughput gene expression data

High throughput biological data need to be processed, analyzed, and interpreted to address problems in life sciences. Bioinformatics, computational biology, and systems biology deal with biological problems using computational methods. Clustering is one of the methods used to gain insight into biological processes, particularly at the genomics level. Clearly, clustering can be used in many areas of biological data analysis. However, this paper presents a review of the current clustering algorithms designed especially for analyzing gene expression data. It is also intended to introduce one of the main problems in bioinformatics – clustering gene expression data – to the operations research community.     

Honeymoon with IWBs: A qualitative insight in primary students' views on instruction with interactive whiteboard

The main purpose of this study was to investigate the views of primary students about interactive whiteboard [IWB] use in their classes from attitudinal and pedagogical perspectives. Research was designed as an empirical approach to phenomenology. Data was collected from fifty primary students (fourth to eighth) through focus group interviews. Nvivo 9 qualitative data analysis software was used to analyze data. Results showed that students like instruction with IWB especially for such reasons/capabilities as practical and economical use, better visual presentation, and test-based use. Students were predominantly uncomfortable with the technical problems. They believed that instruction with IWB positively impacted their learning especially because of visualization and contextualization, effective presentation, test-based use, and motivational factors. Finally it was inferred that IWBs were not used to their full potential, and both technical problems and common practices indicated that teachers were still at an initial stage of transmission to instruction with IWB and they needed both technical and pedagogical training.     

Multirobot coordination in pick-and-place tasks on a moving conveyor

This paper considers the problem of multirobot coordination in pick-and-place tasks on a conveyor band. The robot team is composed of identical robots with mutually exclusive, but neighboring workspaces. The products are fed in at one end of the band, move through each workspace sequentially until being picked up and are collected at the other end—if not picked up interim. Each robot has the same task—that is picking up and packaging as many products as possible. We propose an approach based on noncooperative game theory where each robot uses local observations of the conveyor band and their neighbors' actions in order to decide on its actions. The developed algorithm has been implemented and tested in a simulated manufacturing environment using Webots. Results obtained from the simulations are analyzed using a variety of statistical performance measures.     

Design of a framework for modeling, integration and simulation of physiological models

Multiscale modeling and integration of physiological models carry challenges due to the complex nature of physiological processes. High coupling within and among scales present a significant challenge in constructing and integrating multiscale physiological models. In order to deal with such challenges in a systematic way, there is a significant need for an information technology framework together with related analytical and computational tools that will facilitate integration of models and simulations of complex biological systems. Physiological Model Simulation, Integration and Modeling Framework (Phy-SIM) is an information technology framework providing the tools to facilitate development, integration and simulation of integrated models of human physiology. Phy-SIM brings software level solutions to the challenges raised by the complex nature of physiological systems. The aim of Phy-SIM, and this paper is to lay some foundation with the new approaches such as information flow and modular representation of the physiological models. The ultimate goal is to enhance the development of both the models and the integration approaches of multiscale physiological processes and thus this paper focuses on the design approaches that would achieve such a goal.