zinc15

Clustered subsets in ZINC15?

On the ZINC12 site there are clustered versions of subsets, for example the 'Leads Now' subset can be represented at the 90% Tanimoto cutoff level by 322,638 structures:

http://zinc.docking.org/subsets/leads-now

However, I couldn't find the ability to download clustered subsets in ZINC15. Is it available? Thanks.

combining, OR (smarts) with Substructure seaching?

HI,
Is there a way to combine smarts OR, with other methods such as substructure searching? (or is there anything similar available)?

thanks

Syndicate content