wangyingxie
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wangyingxie
> UFFTYPER: Warning: hybridization set to SP3 for atom 1 Thanks for your notes. Then do you know how to deal with this issue?
> The RDKit is currently not able to reliably generate conformer for octahedral species. > This will hopefully be fixed in a future release. Thanks for letting me know.
Nope On Fri, May 12, 2023 at 2:37 PM teltim ***@***.***> wrote: > What is the progress on this? > > — > Reply to this email directly, view it...