Charlie Zhu wrote:
> I have tested a few RXN files on Openbabel GUI on Windows but 0 result
> has been output. One of the RXN file is attached.
> I temporarily have to use Regexp to parse the RXN format to SDF as C#
> code as pasted below. It is even not trusted by myself.
>
> f
> I have tested a few RXN files on Openbabel GUI on Windows but 0 result has
> been output. One of the RXN file is attached.
RXN format is definitely supported for reaction conversion (e.g., to CML
reaction formats). What exactly are you trying to do in the GUI?
Thanks,
-Geoff
Hi,
I have tested a few RXN files on Openbabel GUI on Windows but 0 result has
been output. One of the RXN file is attached.
I temporarily have to use Regexp to parse the RXN format to SDF as C# code
as pasted below. It is even not trusted by myself.
f = Regex.Replace(f, "\\$RXN(.
