tagirshin commited on
Commit
dbcf05d
1 Parent(s): f5d4008

changed messages to the toast ones

Browse files
Files changed (1) hide show
  1. app.py +7 -2
app.py CHANGED
@@ -325,6 +325,7 @@ if submit_side or submit_main:
325
  batch_size = 250
326
  random_seed = 44
327
 
 
328
  X, Y, rf_model, vqgae_model, ordering_model = load_data(batch_size)
329
  assert X.shape == (603, 4096)
330
  start_time = time()
@@ -358,7 +359,9 @@ if submit_side or submit_main:
358
 
359
  with st.spinner('Getting unique solutions'):
360
  unique_solutions = list(set(tuple(s) for s in ga_instance.solutions))
361
- st.success(f'{len(unique_solutions)} solutions were obtained')
 
 
362
 
363
  scores = {
364
  "rf_score": [],
@@ -399,7 +402,8 @@ if submit_side or submit_main:
399
  chosen_ids = chosen_gen.index.to_list()
400
  chosen_solutions = np.array([unique_solutions[ind] for ind in chosen_ids])
401
  gen_frag_inds = frag_counts_to_inds(chosen_solutions, max_atoms=51)
402
- st.info(f'The number of chosen solutions is {gen_frag_inds.shape[0]}', icon="ℹ️")
 
403
 
404
  gen_molecules = []
405
  results = {"smiles": [], "ordering_score": [], "validity": []}
@@ -451,6 +455,7 @@ if submit_side or submit_main:
451
  mins_used = int(round(time_used // 60, 0))
452
  seconds_used = int(round(time_used % 60, 0))
453
  st.success(f'{filtered_gen_stats.shape[0]} valid solutions were obtained in {mins_used} mins {seconds_used} secs')
 
454
 
455
  st.subheader('Generation results', divider='rainbow')
456
  st.dataframe(filtered_gen_stats)
 
325
  batch_size = 250
326
  random_seed = 44
327
 
328
+ st.toast('Optimisation is started. The progress will be printed below')
329
  X, Y, rf_model, vqgae_model, ordering_model = load_data(batch_size)
330
  assert X.shape == (603, 4096)
331
  start_time = time()
 
359
 
360
  with st.spinner('Getting unique solutions'):
361
  unique_solutions = list(set(tuple(s) for s in ga_instance.solutions))
362
+
363
+ st.toast(f'{len(unique_solutions)} latent vectors were obtained')
364
+ # st.success(f'{len(unique_solutions)} solutions were obtained')
365
 
366
  scores = {
367
  "rf_score": [],
 
402
  chosen_ids = chosen_gen.index.to_list()
403
  chosen_solutions = np.array([unique_solutions[ind] for ind in chosen_ids])
404
  gen_frag_inds = frag_counts_to_inds(chosen_solutions, max_atoms=51)
405
+ st.toast(f'The number of chosen latent vectors is {gen_frag_inds.shape[0]}')
406
+ # st.info(f'The number of chosen solutions is {gen_frag_inds.shape[0]}', icon="ℹ️")
407
 
408
  gen_molecules = []
409
  results = {"smiles": [], "ordering_score": [], "validity": []}
 
455
  mins_used = int(round(time_used // 60, 0))
456
  seconds_used = int(round(time_used % 60, 0))
457
  st.success(f'{filtered_gen_stats.shape[0]} valid solutions were obtained in {mins_used} mins {seconds_used} secs')
458
+ st.balloons()
459
 
460
  st.subheader('Generation results', divider='rainbow')
461
  st.dataframe(filtered_gen_stats)