Re: [Rdkit-discuss] problem with overlap in drawing.

[Paul E. <pau...@bi...>]

For the record, there's little added complexity compiling from the svn 
repo than using the release tar file.


On 02/07/12 11:48, Adrian Jasiński wrote:
> 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<gre...@gm...>:
>> An update on this thread:
>>
>> On Tue, Jun 19, 2012 at 9:19 AM, Adrian Jasiński
>> <jas...@gm...>  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
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