Molecular structure input on the web.
Molecular structure input on the web.
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DOI：
10.1186/1758-2946-2-1
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发表时间：
2010-02-02
影响因子：
8.6
通讯作者：
Ertl P
中科院分区：
文献类型：
--
作者：
Ertl P
分子编辑器，即用于分子的输入和编辑程序，是每个化学形式或分子加工系统的必不可少的一部分。这篇综述着重于一种特殊类型的分子编辑器，即用于网络分子结构输入的分子编辑器。科学计算现在越来越多地朝着网络服务和云计算的方向发展，服务器散布在互联网周围。因此，Web浏览器已成为通用的科学用户界面，并且在Web浏览器中直接编辑分子的工具至关重要。
该评论涵盖了基于Web的结构输入的历史记录，从简单的文本输入框和基于单击地图的早期分子编辑器开始，然后转到以Java Applet为主导的当前情况。一个典型的例子 - 流行的JME分子编辑器 - 将更详细地描述。还提出了现代AJAX服务器端分子编辑器。最后，讨论了基于JavaScript和Flash等技术的基于Web的分子编辑的未来方向。
A molecule editor, that is program for input and editing of molecules, is an indispensable part of every cheminformatics or molecular processing system. This review focuses on a special type of molecule editors, namely those that are used for molecule structure input on the web. Scientific computing is now moving more and more in the direction of web services and cloud computing, with servers scattered all around the Internet. Thus a web browser has become the universal scientific user interface, and a tool to edit molecules directly within the web browser is essential. The review covers a history of web-based structure input, starting with simple text entry boxes and early molecule editors based on clickable maps, before moving to the current situation dominated by Java applets. One typical example - the popular JME Molecule Editor - will be described in more detail. Modern Ajax server-side molecule editors are also presented. And finally, the possible future direction of web-based molecule editing, based on technologies like JavaScript and Flash, is discussed.
影响因子：
3
作者：
Ertl, P;Mühlbacher, J;Selzer, P
通讯作者：
Selzer, P