Dear Experts,
I am trying to figure out a way to exclude entries which contain heavy
atoms (13C, 2H, 3H, etc), from a SD file (which has close to two thousand
entries) and write an updated file with the remaining entries.
I do understand how to read/write SD files using rdkit.
What I do understand is how to detect entries with heavy isotopes: Is there
an efficient and correct way of achieving this using rdkit?
thanks,
--
Milinda Samaraweera
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