Re: [Cdk-devel] sources of atomic and elemental data

[Egon W. <ego...@gm...>]

On Mon, Oct 20, 2008 at 12:21 AM, Rajarshi Guha <rg...@in...> wrote:
> Hi, I was poking around for covalent radii and while look in
>
> src/main/org/openscience/cdk/config/data
>
> I was wondering where exactly did chemicalElements.xml come from? It
> certainly doesn't match the elements.xml file from the BODR (from
> which we are using the electronegativity, VdW radius and soon
> covalent radii). Or was it just extracted from the BODR file?

Miguel, can you reply to this, as you added the file?

The file came from:

http://cdk.svn.sourceforge.net/viewvc/cdk/trunk/cdk/src/org/openscience/cdk/config/data/chemicalElements.xml?view=log&pathrev=10000

With it's commit log at:

http://cdk.svn.sourceforge.net/viewvc/cdk?view=rev&revision=4407

Egon

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