Ir database

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Ir, which is the enumeration of the bespoke chemistry, is the other side of Fe (the Hartenfeller reactions)

Found on our cluster at

/nfs/exe/Ir/

Using Chemspace Building Blocks (480K) the enumerations are in

/mnt/nfs/exe/Ir/Chemspace0324/ChemspaceBB_enumerated

there are also some in /mnt/nfs/exe/Ir

they are also available on Wynton /wynton/group/bks/Iridium-24/


They are also available on AWS. aws:///zinc3d/Ir