Hi Michal,
that's an easy-to-fix bug. Would you mind putting something in github? I'll
fix it today or tomorrow.
-greg
On Mon, Jan 20, 2014 at 2:21 PM, Michał Nowotka <[email protected]> wrote:
> Hi,
>
> Do you know why RDKit tend to render binary compounds as ClH, FH, BrH or
> IH rather than putting H first? Can this behavior be controlled by any
> setting/flag?
> I attach two examples for CHEMBL2095211 (Lorcaserin hydrochloride).
> The first one is what I would expect to have the second is RDkit generated
> image.
>
> Regards,
> Michal Nowotka
>
>
>
> ------------------------------------------------------------------------------
> CenturyLink Cloud: The Leader in Enterprise Cloud Services.
> Learn Why More Businesses Are Choosing CenturyLink Cloud For
> Critical Workloads, Development Environments & Everything In Between.
> Get a Quote or Start a Free Trial Today.
>
> http://pubads.g.doubleclick.net/gampad/clk?id=119420431&iu=/4140/ostg.clktrk
> _______________________________________________
> Rdkit-discuss mailing list
> [email protected]
> https://lists.sourceforge.net/lists/listinfo/rdkit-discuss
>
>
------------------------------------------------------------------------------
CenturyLink Cloud: The Leader in Enterprise Cloud Services.
Learn Why More Businesses Are Choosing CenturyLink Cloud For
Critical Workloads, Development Environments & Everything In Between.
Get a Quote or Start a Free Trial Today.
http://pubads.g.doubleclick.net/gampad/clk?id=119420431&iu=/4140/ostg.clktrk
_______________________________________________
Rdkit-discuss mailing list
[email protected]
https://lists.sourceforge.net/lists/listinfo/rdkit-discuss