VChemLab: A virtual chemistry laboratory. The storage, retrieval, and display of chemical information using standard Internet tools

被引:21
作者
Rzepa, HS [1 ]
Tonge, AP [1 ]
机构
[1] Univ London Imperial Coll Sci Technol & Med, Dept Chem, London SW7 2AY, England
来源
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES | 1998年 / 38卷 / 06期
关键词
D O I
10.1021/ci9803280
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
The design and implementation of two interactive Internet-based applications for the storage, retrieval, and display of molecular structures, spectra, and physicochemical properties is described. The first, suitable for small-scale laboratory or teaching applications, uses a JavaScript-controlled structure to load data from discrete files located on a server ora CD-ROM into a local Web browser. The second, developed for scaling to larger commercial-sized applications, uses a Java-based Distributed Object Computing architecture to allow a local client applet to have persistent access to a remote object database, in which information for the different chemical classes has been stored. Both browser applications have a dynamically created page structure and use readily available Plugins and Java applets for the; active display of three-dimensional molecular structures and their experimental spectra.
引用
收藏
页码:1048 / 1053
页数:6
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