Thanks for that, I hope it will help. I will wait for next release and
check other structures drawing.
Unfortunately I can't publish all structures with errors (for security
reasons), but I will try next version and I let you know if I will
find any similar errors.
2012/7/2 Greg Landrum <greg.land...@gmail.com>:
> An update on this thread:
>
> On Tue, Jun 19, 2012 at 9:19 AM, Adrian Jasiński
> <jasinski.adr...@gmail.com> wrote:
>>
>> There is some example code:
>>
>> from rdkit import Chem
>> from rdkit.Chem import Draw
>> mol = Chem.MolFromSmiles('CC(=O)Nc1ccccc1C(=O)C1CCCC1C1CCCCC1')
>> Draw.MolToFile(mol,'test.png')
>>
>
> I made some change to the depictor this morning that handle this case
> as well as a few other problematic cases. These will be in the next
> release
>
> There are definitely still some problems in the depictor, but it's
> better now than it was. Adrian: thanks for reporting this failure.
>
> -greg
------------------------------------------------------------------------------
Live Security Virtual Conference
Exclusive live event will cover all the ways today's security and
threat landscape has changed and how IT managers can respond. Discussions
will include endpoint security, mobile security and the latest in malware
threats. http://www.accelacomm.com/jaw/sfrnl04242012/114/50122263/
_______________________________________________
Rdkit-discuss mailing list
Rdkit-discuss@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/rdkit-discuss
