Perfect, thank you!
On Fri, Sep 15, 2017 at 9:47 AM, Greg Landrum wrote:
>
>
> On Fri, Sep 15, 2017 at 9:25 AM, Michał Nowotka wrote:
>>
>> Thanks Greg, very helpful!
>> Can you tell me how should I modify my code to provide the list of
>> bonds to be
On Fri, Sep 15, 2017 at 9:25 AM, Michał Nowotka wrote:
> Thanks Greg, very helpful!
> Can you tell me how should I modify my code to provide the list of
> bonds to be highlighted, so I get the image generated by DrawMolecules
> looking the same way as produced by DrawMolecule?
Thanks Greg, very helpful!
Can you tell me how should I modify my code to provide the list of
bonds to be highlighted, so I get the image generated by DrawMolecules
looking the same way as produced by DrawMolecule?
On Thu, Sep 14, 2017 at 4:36 PM, Greg Landrum wrote:
> Hi
Hi Michal,
There are a couple of things in here.
On Fri, Aug 25, 2017 at 11:42 AM, Michał Nowotka wrote:
> Hi,
>
> I finally decided to try the new C++ drawing code and I found some
> issues with it. I'll try to descibe my problems.
>
> First, lets start with a code that
Hi,
I finally decided to try the new C++ drawing code and I found some
issues with it. I'll try to descibe my problems.
First, lets start with a code that works perfectly:
from rdkit import Chem
from rdkit.Chem.AllChem import Compute2DCoords
from rdkit.Chem.Draw import rdMolDraw2D
m =
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