I would like to use ForwardSDMolSupplier to read directly from standard in.
This is possible using the normal SDMolSupplier by using something like:
supp = Chem.SDMolSupplier()
data = sys.stdin.read()
## NB This is not the nicest way to do it - especially if the file is
massive (it is held in variable data) - but will do.
suppl.SetData(data, sanitize = True)
data = None # <- do this last step to free up memory in case the file is
large
Can the empty constructor and SetData be added to ForwardSDMolSupplier ?
(possibly this is common behaviour across all Suppliers... and its
righteous place is in the superclass)
Many Thanks,
-
Jean-Paul Ebejer
Early Stage Researcher
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