ChIN简介页:NMRShiftDB (NMR谱图数据库和NMR谱图预测)
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NMRShiftDB (NMR谱图数据库和NMR谱图预测)

【URL】 http://nmrshiftdb.cubic.uni-koeln.de/nmrshiftdb

【收费情况】
 免费

【数据内容】
     NMRShiftDB is a web database for organic structures and their nuclear magnetic resonance (nmr) spectra. It allows for spectrum prediction (currently only for carbon) as well as for searching spectra, structures and other properties. Last not least, it features peer-reviewed submission of datasets by its users. The NMRShiftDB software is open source, the data is published under an open content license.

Status of NMRShiftDB up to Dec 25 2006:

Registered Users: 1082
Structures which can be searched: 19366
Spectra: Measured 22836, calculated 495

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【相关链接】
  分子信息学博客SteinBlog
  Natural Products 13C NMR Database (天然产物核磁碳谱数据库NAPROC-13)


Summary by 李晓霞 on 2006-12-25

Last updated by 李晓霞 on 2006-12-25

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