[Kalzium] Two versions of Kalzium?

[Carsten Niehaus]

On Thursday 15 September 2005 18:59, Daniel Franke wrote:
Hi

> if you are going to start with amino acids, next step is a front end for
> PDB (proteine database, http://www.rcsb.org/pdb/) -- do you really want to
> go THAT far?

Well, there are 22 aminoacids (ok, perhaps 30 or so, but not in human bodies) 
but billions of proteins. That is quite a difference. Furthermore, AS have < 
30 atoms while protients have in a average 400 AS => 12000 atoms. That is the 
other big difference.
Furthermore, the aminoacids are already written in xml as you can see in [1]. 

Why not expanding Kalziums abilities?

Carsten

[1] -- 
http://cvs.sourceforge.net/viewcvs.py/cdk/cdk/src/data/templates/list_aminoacids.cml?rev=1.3&view=markup
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