Hello all,
I have a little question.
I don't arrive to read 2 SDF files with RDKIT when I use the for loop.
I explain
I have a first sdf files with 1 property and a second with another properties.
I put the second SDMolSupplier instead of "suppl" and load a sdf file ( look
exemple)
If I replace the SDMolSupplier by a text file the program don't have a problem.
I just search a writer to read 2 SDF ....
Tks
Cedric
reader1 = Chem.SDMolSupplier("C:\Data\scaffold/Total/totalscaffold.sdf.sdf")
writer = Chem.SDWriter("C:\Data\scaffold/Eval/evalcount.sdf")
z = 0
for mol in reader1:
h = Chem.MolToSmiles(mol)
suppl = open('C:\Data\scaffold/Total/total.txt','r')
for a in suppl:
r = 0
r+=1
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