Re: [Rdkit-discuss] AllChem.DeleteSubstructs question

Hello: Greg's suggestions worked out. Best, Markus On Fri, Sep 16, 2016 at 1:44 PM, Greg Landrum wrote: > Glad to hear it. Would you mind replying to the list as well so that the > thread is closed? > > Best, > -greg > > > On Fri, Sep 16, 2016 at 1:33 PM, Markus Metz

Re: [Rdkit-discuss] AllChem.DeleteSubstructs question

Hi Markus, On Fri, Sep 16, 2016 at 11:35 AM, Markus Metz wrote: > Hello everybody: > > I am working on a script which removes the cores based on a given pattern > and I am wondering how I can accomplish that if two matches are present in > the parent molecule two outputs are

[Rdkit-discuss] AllChem.DeleteSubstructs question

Hello everybody: I am working on a script which removes the cores based on a given pattern and I am wondering how I can accomplish that if two matches are present in the parent molecule two outputs are generated with each matching pattern deleted once. ReplaceSubstructs seems to have an option