change setup

marrink-lab · Aug 14, 2024 · b2d5155 · b2d5155
1 parent e818063
commit b2d5155
Showing 1 changed file with 1 addition and 0 deletions.
diff --git a/setup.cfg b/setup.cfg
@@ -38,6 +38,7 @@ install-requires =  # ?? requires-dist?
     vermouth >= 0.9.6
     scipy >= 1.6.0
     tqdm
+    cgsmiles @ git+https://github.com/gruenewald-lab/CGsmiles.git@master
 zip-safe = False