Hi,
I have a related bug. Just downloaded OpenBabel-3.0.0-x86.exe from GitHub
but it was generating corrdinates with too many digits. Excerpt from PDBQT
file overflowing the coords mask:
ATOM 1 N UNL 12261608.7291334600.251 0.000 0.00 0.00
> +0.000 NA
>
The command line was:
I'm just a humble user but agree to a single executable like git.
Em seg, 2 de mar de 2020 17:12, Noel O'Boyle
escreveu:
> It's not a popular opinion, but I think we should have a single robust
> executable. I've never used any of the others, and they are mostly untested.
>
> On Sat, 29 Feb 2020
I face the same issue.
Em qua, 2 de dez de 2020 08:18, Antonio Jesús Banegas Luna <
ajbane...@ucam.edu> escreveu:
> Hello,
>
> I'm using obabel for converting smiles to 3d mol2 with --gen3D. However,
> when I run the command on another machine I get a different set of
> coordinates that make the
