When I use FastSearch, the numbers added by addinindex seem to always start from 1, unlike searching the original SDF. Am I doing it wrong?
$ obabel -isdf ./small_db.sdf -osmi --addoutindex --addinindex -s"n1ccccc1" c12ccccc2[n+](c(cc1)/*=*/C=c/1\ccc2ccccc2n1CC)CC 0261.cdx#1 49 1 [n+]1(CC)ccc(/*=*/C=c/2\ccn(CC)c3ccccc23)c2ccccc12 0260.cdx#1 51 2 2 molecules converted $ obabel -ifs ./small_db.fs -osmi --addoutindex --addinindex -s"n1ccccc1" 2 candidates from fingerprint search phase c12ccccc2[n+](c(cc1)/*=*/C=c/1\ccc2ccccc2n1CC)CC 0261.cdx#1 1 1 [n+]1(CC)ccc(/*=*/C=c/2\ccn(CC)c3ccccc23)c2ccccc12 0260.cdx#1 2 2 2 molecules converted -- A. Heifets http://www.cs.toronto.edu/~aheifets/ ------------------------------------------------------------------------------ All of the data generated in your IT infrastructure is seriously valuable. Why? It contains a definitive record of application performance, security threats, fraudulent activity, and more. Splunk takes this data and makes sense of it. IT sense. And common sense. http://p.sf.net/sfu/splunk-d2d-c2 _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
