ue for me just an obeservation).So from that point I can
> see and understand the need for using a custom fingerprint for the
> screenout step.
>
> Best Regards,
>
> Thomas
> --
> *Von:* Greg Landrum
> *Gesendet:* Samstag, 25. Januar 2020 06:11
screenout step.
Best Regards,
Thomas
Von: Greg Landrum
Gesendet: Samstag, 25. Januar 2020 06:11
An: Chicago Ji
Cc: rdkit-discuss
Betreff: Re: [Rdkit-discuss] How does rdkit cartridge work?
Hi Changge,
On Fri, Jan 24, 2020 at 5:14 PM Chicago Ji
mailto:chica
Greg is too modest to mention it, but he recently blogged on performance
aspects of the cartridge which covers many aspects of how it works:
http://rdkit.blogspot.com/2020/01/some-thoughts-on-performance-of-rdkit.html
On 25/01/2020 05:11, Greg Landrum wrote:
Hi Changge,
On Fri, Jan 24, 2020
Hi Changge,
On Fri, Jan 24, 2020 at 5:14 PM Chicago Ji wrote:
>
> I find that rdkit cartridge is quite efficient in substructure searching.
>
Glad to hear that! :-)
> Is there any paper or similar paper that describes things behind rdkit
> cartridge?
>
No, just the documentation.
> For
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