Unfortunately, neither the current release nor development code can handle
rsmi from Python. If you wish to do this, you should check out the branch
referred to in the following pull request:
https://github.com/openbabel/openbabel/pull/1836
Regards,
- Noel
On 16 July 2018 at 15:28, Mirko Hu <mirko...@hotmail.it> wrote:
> Hello,
>
>
> I am trying to open a large .rsmi file (443 MB) with Python (open babel
> library), but every time I try the script freezes. I have tried also to
> split the file through Open Babel software for Windows, but I could not do
> that.
>
>
> I need to go through the reactions contained in the file to select the
> reactions related to a certain group of compounds.
>
>
> Thanks in advance for your help.
>
>
> Best regards,
>
> Mirko Hu
>
> ------------------------------------------------------------
> ------------------
> Check out the vibrant tech community on one of the world's most
> engaging tech sites, Slashdot.org! http://sdm.link/slashdot
> _______________________________________________
> OpenBabel-discuss mailing list
> OpenBabel-discuss@lists.sourceforge.net
> https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
>
>
------------------------------------------------------------------------------
Check out the vibrant tech community on one of the world's most
engaging tech sites, Slashdot.org! http://sdm.link/slashdot
_______________________________________________
OpenBabel-discuss mailing list
OpenBabel-discuss@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
