Dataset

Chemical Structure Repository

Added By Infochimps
  1. Description

From project website:

> Chemical Structures [was] initiated in June 2006. It aims to provide a set of organic structures, which includes 3D coordinates, InChi code, molecular weight, melting point, etc. The last relase (v1.05) contains over 250 structures.

  1. License

BSD license according to [SourceForge project page](http://sourceforge.net/projects/chem-file/).

  1. Repository

There is a subversion repository at:

  • [http://wiki.cubic.uni-koeln.de/repos/blueobelisk/trunk/structures/](http://wiki.cubic.uni-koeln.de/repos/blueobelisk/trunk/structures/)