Good, thank you Sereina!
Ling
Sereina Riniker 於 2022年6月19日週日 上午1:48寫道：
> Dear Ling,
>
> Yes, the atom indexing is the same for all conformers of a molecule.
>
> Best regards,
> Sereina
>
>
>
> > On 19 Jun 2022, at 00:04, Ling Chan wrote:
> >
> > Dear colleagues,
> >
> > Just wonder if the atom
Dear Ling,
Yes, the atom indexing is the same for all conformers of a molecule.
Best regards,
Sereina
> On 19 Jun 2022, at 00:04, Ling Chan wrote:
>
> Dear colleagues,
>
> Just wonder if the atom indexing in a conformer is always identical to that
> of the parent molecule? I suspect it is
Dear colleagues,
Just wonder if the atom indexing in a conformer is always identical to that
of the parent molecule? I suspect it is but would like to confirm.
Specifically, I would like to confirm that
for conf in mol.GetConformers():
conf.GetAtomPosition(idx)
always corresponds to the
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