Re: [Cdk-devel] Fwd: DeduceBondSystemToolTest

[Rajarshi G. <rg...@in...>]

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On May 21, 2008, at 12:45 PM, Egon Willighagen wrote:
> ---------- Forwarded message ----------
> From: Andreas Schueller <a.s...@ch...>
> Date: Wed, May 21, 2008 at 3:39 PM
> Subject: DeduceBondSystemToolTest
> To: Egon Willighagen <ego...@gm...>
>
> Now the actual questions is:
> Should atom types be perceived by the test case or by
> DeduceBondSystemTool or by CDKHueckelAromaticityDetector?

My understanding is that atom type perception should be done in  
client code (i.e., the test case for ths example) rather than in  
aromaticity etc classes

- -------------------------------------------------------------------
Rajarshi Guha  <rg...@in...>
GPG Fingerprint: D070 5427 CC5B 7938 929C  DD13 66A1 922C 51E7 9E84
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There's no problem so bad that you can't add some guilt to it to make
it worse.
                 -Calvin


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