Difference between revisions of "ZINC15 Database"
From Rizzo_Lab
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The lead-like tranche: | The lead-like tranche: | ||
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== References == | == References == | ||
Revision as of 14:08, 1 November 2016
The ZINC15 database is an updated version of ZINC12 and contains over 100 million purchasable compounds for virtual screening.
How to download molecules by catalog?
A general stepwise instruction can be found at Download by catalog
If you would like to download compounds from ChemDiv, The ZINC ID mapping:
http://files.docking.org/catalogs/50/cdiv/cdiv-zinc.txt.gz
The lead-like tranche:
http://files.docking.org/catalogs/50/cdiv/lead-like.tgz
Ref: reference models (dominate form at pH7.4) Mid: additional forms present at pH7.4
