Merge branch 'feature/sdf-support' of https://github.com/ChEB-AI/python-chebai-graph into feature/sdf-support

sfluegel05 · sfluegel05 · commit e78183e9e0e2 · 2026-03-02T09:43:49.000+01:00
diff --git a/chebai_graph/preprocessing/bin/AtomNumHs/indices_one_hot.txt b/chebai_graph/preprocessing/bin/AtomNumHs/indices_one_hot.txt
@@ -5,3 +5,4 @@
 1
 5
 6
+8
diff --git a/chebai_graph/preprocessing/bin/BondType/indices_one_hot.txt b/chebai_graph/preprocessing/bin/BondType/indices_one_hot.txt
@@ -3,3 +3,4 @@ SINGLE
 AROMATIC
 TRIPLE
 DOUBLE
+UNSPECIFIED
diff --git a/chebai_graph/preprocessing/bin/NumAtomBonds/indices_one_hot.txt b/chebai_graph/preprocessing/bin/NumAtomBonds/indices_one_hot.txt
@@ -9,3 +9,5 @@
 7
 10
 12
+11
+9
