NMRShiftDB - Constructing a free chemical information system with open-source components

被引：134

作者：

Steinbeck, C ^{[1
]}

Krause, S ^{[1
]}

Kuhn, S ^{[1
]}

机构：

[1] Max Planck Inst Chem Ecol, Jena, Germany

来源：

JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES | 2003年 / 43卷 / 06期

关键词：

D O I：

10.1021/ci0341363

中图分类号：

O6 [化学];

学科分类号：

0703 [化学];

摘要：

The process of designing and implementing NMRShiftDB, an open-source, open-content database for chemical structures and their NMR data based solely on free software is described. NMRShiftDB is available to the community on http://www.nmrshiftdb.org. It allows for open submission and retrieval of data sets by its user community. The software and the content itself is freely distributable, allowing for the establishment of a highly available mirror system of databases in collaborating laboratories.

引用

页码：1733 / 1739

页数：7

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