add ms2deepscore

florian-huber · florian-huber · commit acf43f4457d6 · 2025-11-06T10:58:32.000+01:00
diff --git a/pyproject.toml b/pyproject.toml
@@ -28,6 +28,7 @@ pandas = ">=2.1.1"
 scipy= ">=1.14.0"
 matplotlib= ">=3.8.0"
 matchms= ">=0.30.0"
+ms2deepscore= ">=2.3.0"
 rdkit= ">2024.3.4"
 faiss-cpu= ">=1.10.0"
 
