Hi Stuart, Can you please share the input file you used here? Without that it's hard to track down the problem.
On Tue, Jul 14, 2020 at 6:43 PM Itastu Da Mac <italoand...@gmail.com> wrote: > Hi all, > > I would like to get the shortest path between two aluminum atoms in a > zeolite molecule; however, I'm getting a problem using GetShortestPath(). A > single bond between aluminum and oxygen is not being recognized, and as > such, the shortest path is not being returned correctly. The single bond in > question is being recognized by molecular viewing software such as > MacMolPlt. I was wondering if there's anything I can do to fix this? > > Here's a link to a screenshot of the code as well as the molecule in > question: > https://imgur.com/a/JNlYGnF > > Thanks, > Stuart > _______________________________________________ > Rdkit-discuss mailing list > Rdkit-discuss@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/rdkit-discuss >
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