Bugs item #2655441, was opened at 2009-03-02 20:43
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Category: Commands / Extensions
Group: None
Status: Open
Resolution: None
Priority: 5
Private: No
Submitted By: Nobody/Anonymous (nobody)
Assigned to: Nobody/Anonymous (nobody)
Summary: UFF Auto Opt crashes
Initial Comment:
Auto Opt crashes to desktop on any method when using UFF.
AppName: avogadro.exe AppVer: 0.0.0.0 ModName: openbabel-2.dll
ModVer: 0.0.0.0 Offset: 000dced6
Calculations on same molecule with GChemical FF proceeds fine.
CML file attached for reference.
Keep up the good work - this is a really important project!
You can respond by visiting:
https://sourceforge.net/tracker/?func=detail&atid=835077&aid=2655441&group_id=165310