Re: [Joelib-devel] Molecular Fingerprinting

[joerg.wegner <joe...@we...>]

Priyashree,

 

what exactly is your goal? You can create BitStrings or binary or counted
feature counts. Please let me know what exactly you need.

For similarity analysis there is already an additional helper class
available.

 

Best regards, Joerg

 

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Von: joe...@li...
[mailto:joe...@li...] Im Auftrag von
priyashree saxena
Gesendet: Samstag, 8. Juli 2006 20:58
An: joe...@li...
Betreff: [Joelib-devel] Molecular Fingerprinting

 

Hi 

 

I want to perform Molecular Fingerprinting, I read in the applications that
JOELIB2 supports fingerprinting. Can you help me by specifying how I could
do it on a molecule.

 

Thanks,

Priyashree Saxena

  

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