Update app.py

app.py

@@ -1121,10 +1121,9 @@ def update_df(file, progress=gr.Progress(track_tqdm=True)):
 
 def create_html_report(df, file=None, task=None, opts=(), progress=gr.Progress(track_tqdm=True)):
     df_html = df.copy(deep=True)
-    df_html.dropna(how='all', axis=1, inplace=True)
     column_aliases = COLUMN_ALIASES.copy()
     cols_left = list(pd.Index([
-            'ID1', 'ID2', 'Compound', 'Scaffold', 'Pharmacophore', 'X1', 'Scaffold SMILES', 'X2', 'Y^'
+        'ID1', 'ID2', 'Compound', 'Scaffold', 'Pharmacophore', 'X1', 'Scaffold SMILES', 'X2', 'Y^'
     ]).intersection(df_html.columns))
     # cols_right = list(pd.Index(['X1', 'X2']).intersection(df_html.columns))
     # df_html = df_html[cols_left + (df_html.columns.drop(cols_left + cols_right).tolist()) + cols_right]
@@ -1208,6 +1207,8 @@ def create_html_report(df, file=None, task=None, opts=(), progress=gr.Progress(t
     if columns_unique is not None:
         unique_df = df_html.loc[:, columns_unique].iloc[[0]].copy()
         df_html = df_html.loc[:, ~columns_unique]
+        df_html.dropna(how='all', axis=1, inplace=True)
+        unique_df.dropna(how='all', axis=1, inplace=True)
 
     if not file:
         if 'Compound ID' in df_html.columns:
@@ -1299,9 +1300,10 @@ def create_html_report(df, file=None, task=None, opts=(), progress=gr.Progress(t
         report_table = pn.widgets.Tabulator(
             df_html, formatters=formatters,
             frozen_columns=[
-                'Index', 'Target ID', 'Compound ID', 'Compound'
+                'Index', 'Target ID', 'Compound ID', 'Compound Name', 'Compound'
             ],
-            disabled=True, sizing_mode='stretch_both', pagination='local', page_size=30)
+            disabled=True, sizing_mode='stretch_both', pagination='local', page_size=30
+        )
 
         for i, col in enumerate(num_cols):
             cmap = sns.light_palette(num_col_colors[i], as_cmap=True)
@@ -1338,6 +1340,7 @@ def create_html_report(df, file=None, task=None, opts=(), progress=gr.Progress(t
             
             .tabulator-cell {
                 overflow: visible !important;
+                align-content: center !important;
             }
             
             .tabulator-cell:hover {
@@ -1381,7 +1384,7 @@ def create_html_report(df, file=None, task=None, opts=(), progress=gr.Progress(t
             raw_css=[panel_css],
             js_files={'panel_custom': 'static/panel.js', '3Dmol': 'static/3Dmol-min.js'},
             # js_modules={'3Dmol': 'static/3Dmol-min.js'},
-            inline=True
+            inline=True,
         )
 
         template = pn.template.VanillaTemplate(