Dear all, In order to have fingerprint of reactions, is it possible to make fingerprint (FP2) difference between 2 (or more) compounds, ? (as daylight finger print do in section 6.2.2 here http://www.daylight.com/dayhtml/doc/theory/theory.finger.html )
More specifically, I can not find if in the description of FP2, same kind of fragment, even finding a number of time in a molecule, is store 1 time or each time meet as I suppose? Any help will be really appreciate Best regards, Marianne -- View this message in context: http://forums.openbabel.org/Need-complementary-information-on-FP2-tp4204108p4204108.html Sent from the General discussion mailing list archive at Nabble.com. ------------------------------------------------------------------------------ Learn Windows Azure Live! Tuesday, Dec 13, 2011 Microsoft is holding a special Learn Windows Azure training event for developers. It will provide a great way to learn Windows Azure and what it provides. You can attend the event by watching it streamed LIVE online. Learn more at http://p.sf.net/sfu/ms-windowsazure _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
