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. Author manuscript; available in PMC: 2021 Jul 16.
Published in final edited form as: J Chem Inf Model. 2020 Oct 29;60(12):6065–6073. doi: 10.1021/acs.jcim.0c00675

Table 1.

In-stock and make-on-demand catalogs

Catalog name Physical? Number Website
ZINC Ro4 in-stock Yes 6,060,000 https://zinc15.docking.org
SMDC Yes 690,125 https://smdc.ucsf.edu
MLSMR Yes 406,098 https://pubchem.ncbi.nlm.nih.gov/source/MLSMR
ZINC Ro4 make-on-demand No 515,000,000 https://zinc15.docking.org