ipd commited on
Commit
e04a2b6
1 Parent(s): bc0a051

update app.py

Browse files
Files changed (1) hide show
  1. app.py +4 -3
app.py CHANGED
@@ -79,7 +79,7 @@ smiles_image_mapping = {
79
  "Mol 5": {"smiles": "C=CCS[C@@H](C)CC(=O)OCC", "image": "img/img5.png"} # Example SMILES for chloroethane
80
  }
81
 
82
- datasets = ["Load Custom Dataset"]
83
 
84
  models_enabled = ["SELFIES-TED", "MHG-GED", "MolFormer", "SMI-TED"]
85
 
@@ -407,8 +407,9 @@ def display_plot(plot_type):
407
 
408
  # Predefined dataset paths (these should be adjusted to your file paths)
409
  predefined_datasets = {
410
- #"BACE": f"./data/bace/train.csv, ./data/bace/test.csv, smiles, Class",
411
- #"ESOL": f"./data/esol/train.csv, ./data/esol/test.csv, smiles, prop",
 
412
  }
413
 
414
 
 
79
  "Mol 5": {"smiles": "C=CCS[C@@H](C)CC(=O)OCC", "image": "img/img5.png"} # Example SMILES for chloroethane
80
  }
81
 
82
+ datasets = [" ", "BACE", "ESOL", "Load Custom Dataset"]
83
 
84
  models_enabled = ["SELFIES-TED", "MHG-GED", "MolFormer", "SMI-TED"]
85
 
 
407
 
408
  # Predefined dataset paths (these should be adjusted to your file paths)
409
  predefined_datasets = {
410
+ " ": " ",
411
+ "BACE": f"./data/bace/train.csv, ./data/bace/test.csv, smiles, Class",
412
+ "ESOL": f"./data/esol/train.csv, ./data/esol/test.csv, smiles, prop",
413
  }
414
 
415