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Example Programs: FINDRXN
(in $DY_ROOT/contrib/src/c/reaction/)
What it does:
Finds reactions with common component reactants and products.
Takes a reactant and product SMILES on input.
Finds all crossreferences for the given SMILES.
Generates and outputs the list of reactions with the components in
common.
What it illustrates:
-
Crossreferences in THOR.
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Component Reaction lookups.