Marcus D. Hanwell
Marcus D. Hanwell
Greetings. Your program is really fantastic thanks for all your hard work. Here is the bug: When I enlarge the C axis using the super cell builder on molecules such...
I am a new used to Avogadro and am trying to import 1FIN.pdb. It crashes every time after saying "opening multi-domain molecule, this may take a while...". I've attached the...
This may be a problem with other property dialogs, too. It seems to only crash when an atom is deleted, e.g. adding new atoms works fine. To reproduce: 1) Build...
When making a molecule and using view->molecule properties, the IUPAC name is unknown when before it was fine. Even with simple molecules such as methyl. Reported by: *anonymous
(Note that this is a separate problem than I reported in PR#2887942, where the "View/All Molecules in File" remained greyed out) Avogadro successfully opens the attached file, and lists the...
This isn't perfectly replicable. At first I thought it happened when I tried to view molecular properties without saving, but I tried to repeat it before submitting this bug report...
Hi whenI use the unitcell builder to add several copies of the same unitcell The nice looking result is not exported in povray. povray only renders a single unit cell....
From Steven Wathen on the mailing list: The highest energy conformer listed (View-Properties-Conformer properties) has an energy of 1190 !! As it turns out, this is the lowest energy conformer...
This may be a documentation issue, but the way I think I am supposed to use the animation feature is to (1) load the multi-structure xyz file with open, (2)...
If you open a current file to edit, you cannot "Save As" to a new filename. The file is always saved to the original filename. Reported by: @ghutchis