feat: add paper link to tautobase ui (#85)

lwehrhan · web-flow · commit 8c8fe62e2c10 · 2025-11-18T14:03:00.000+01:00
diff --git a/src/mlipaudit/ui/tautomers.py b/src/mlipaudit/ui/tautomers.py
@@ -47,7 +47,8 @@ def tautomers_page(
         "how well MLIPs can predict the relative energies and stability of different "
         "tautomeric forms of molecules in-vacuum. "
         "The dataset contains 1391 tautomer pairs with reference QM energies extracted "
-        "from the Tautobase dataset."
+        "from the [Tautobase](https://pubs.acs.org/doi/abs/10.1021/acs.jcim.0c00035) "
+        "dataset."
     )
 
     st.markdown(

Original file line number	Diff line number	Diff line change
`@@ -47,7 +47,8 @@ def tautomers_page(`
`47`	`47`	`"how well MLIPs can predict the relative energies and stability of different "`
`48`	`48`	`"tautomeric forms of molecules in-vacuum. "`
`49`	`49`	`"The dataset contains 1391 tautomer pairs with reference QM energies extracted "`
`50`		`- "from the Tautobase dataset."`
	`50`	`+ "from the [Tautobase](https://pubs.acs.org/doi/abs/10.1021/acs.jcim.0c00035) "`
	`51`	`+ "dataset."`
`51`	`52`	`)`
`52`	`53`
`53`	`54`	`st.markdown(`