urdof7 commited on
Commit
ba4fc00
·
verified ·
1 Parent(s): 3f17744

Added 174 molecules from epoch 15607 for P23975

Browse files
Files changed (1) hide show
  1. P23975_molecules.csv +174 -0
P23975_molecules.csv CHANGED
@@ -19886,3 +19886,177 @@ F35D44FCD6F5DC63_072BC3F5880F3B14_6041_UN,C2(=C1C=N[NH]C1=CC=C2)NC4=CC3=C(CCCN(C
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19887
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19888
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19888
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