Bugs item #3238192, was opened at 2011-03-23 17:53 Message generated for change (Tracker Item Submitted) made by You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=428740&aid=3238192&group_id=40728
Please note that this message will contain a full copy of the comment thread, including the initial issue submission, for this request, not just the latest update. Category: File Translation Group: None Status: Open Resolution: None Priority: 5 Private: No Submitted By: http://fivemack.livejournal.com () Assigned to: Nobody/Anonymous (nobody) Summary: Atom typing problem Initial Comment: Converting http://ligand-expo.rcsb.org/reports/2/2TC/2TC_ideal.pdb to mol2 format using Open Babel 2.2.3 -- Aug 10 2010 -- 13:11:06 on OS X gives output in which atom O3 has Sybyl atom type O.2 (sp2 oxygen) even though it's got a hydrogen attached; I thought O.2 was only for the oxygen in ketones and that the oxygen in hydroxyls was O.3. ---------------------------------------------------------------------- You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=428740&aid=3238192&group_id=40728 ------------------------------------------------------------------------------ Enable your software for Intel(R) Active Management Technology to meet the growing manageability and security demands of your customers. Businesses are taking advantage of Intel(R) vPro (TM) technology - will your software be a part of the solution? Download the Intel(R) Manageability Checker today! http://p.sf.net/sfu/intel-dev2devmar _______________________________________________ OpenBabel-Devel mailing list OpenBabel-Devel@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-devel
