Spaces:
Running
on
Zero
Running
on
Zero
Update utils.py
Browse files
utils.py
CHANGED
@@ -207,7 +207,7 @@ class ReactionPredictionModel():
|
|
207 |
self.forward_model.config.pad_token_id = self.tokenizer.pad_token_id
|
208 |
self.forward_model.to("cuda")
|
209 |
|
210 |
-
@spaces.GPU(duration=
|
211 |
def predict(self, test_loader, task_type):
|
212 |
predictions = []
|
213 |
for i, batch in tqdm(enumerate(test_loader), total=len(test_loader), desc="Evaluating"):
|
@@ -258,7 +258,7 @@ class ReactionPredictionModel():
|
|
258 |
predictions.append(canonized_smiles_list)
|
259 |
|
260 |
rank, invalid_rate = compute_rank(predictions)
|
261 |
-
|
262 |
return rank
|
263 |
|
264 |
def predict_single_smiles(self, smiles, task_type):
|
|
|
207 |
self.forward_model.config.pad_token_id = self.tokenizer.pad_token_id
|
208 |
self.forward_model.to("cuda")
|
209 |
|
210 |
+
@spaces.GPU(duration=30)
|
211 |
def predict(self, test_loader, task_type):
|
212 |
predictions = []
|
213 |
for i, batch in tqdm(enumerate(test_loader), total=len(test_loader), desc="Evaluating"):
|
|
|
258 |
predictions.append(canonized_smiles_list)
|
259 |
|
260 |
rank, invalid_rate = compute_rank(predictions)
|
261 |
+
print(predictions, rank)
|
262 |
return rank
|
263 |
|
264 |
def predict_single_smiles(self, smiles, task_type):
|