Hello,
I use the openbabel API and really exciting to the all the possibilities of
OB. I use C++.
Actually, I have a problem with the fingerprint of a molecule. Naively, I
create a small procedure to assign a fingerprint to a OBMol object
(fp is a global vector<unsigned int> variable)
void Molecule::setFingerPrint (OBMol mol){
OBFingerprint *pFingerPrint;
pFingerPrint->GetFingerprint(&mol, fp);
}
But a segmentation fault means that I make something wrong with this look
small and simple procedure
Any help would be of a great help.
Regards,
Marianne
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