fatmacankara commited on
Commit
9311c3a
·
1 Parent(s): 37bff71

Update code/alphafold_featureVector.py

Browse files
Files changed (1) hide show
  1. code/alphafold_featureVector.py +4 -7
code/alphafold_featureVector.py CHANGED
@@ -195,8 +195,7 @@ def alphafold(input_set, mode, impute):
195
  model_count[k] = int(v / 2) # two types of files for each file.
196
  data_updated = pd.DataFrame(columns = data.columns)
197
  new_ind =0
198
- st.write('DATA')
199
- st.write(data)
200
  for i in data.index:
201
  uniprotID = data.at[i, 'uniprotID']
202
  datapoint = data.at[i, 'datapoint']
@@ -253,8 +252,7 @@ def alphafold(input_set, mode, impute):
253
  data_updated.at[new_ind, 'distance'] = domainDistanceModels(domStart, domEnd, coordinates, varPos)
254
  for col in UNIPROT_ANNOTATION_COLS[0:30]:
255
  allDist = []
256
- st.write('FOR EACH COL')
257
- st.write(col, data.at[i, col])
258
  if (data.at[i, col] != np.NaN) & (data.at[i, col] != 'hit') & (data.at[i, col] != '[]') & (
259
  data.at[i, col] != []):
260
  annots_list = ast.literal_eval(data.at[i, col])
@@ -276,8 +274,7 @@ def alphafold(input_set, mode, impute):
276
  data_updated.at[new_ind, col] = np.NaN
277
 
278
  new_ind +=1
279
- st.write('data_updated')
280
- st.write(data_updated)
281
  data_updated = selectMaxAnnot(data_updated)
282
  data_updated = data_updated.sort_values(['hitTotal', 'annotTotal'], ascending = [False, True])
283
  data_updated = data_updated.drop_duplicates(['datapoint'])
@@ -466,4 +463,4 @@ def alphafold(input_set, mode, impute):
466
  minutes, seconds = divmod(rem, 60)
467
  print("Time passed: {:0>2}:{:0>2}:{:05.2f}".format(int(hours), int(minutes), seconds))
468
 
469
- return data
 
195
  model_count[k] = int(v / 2) # two types of files for each file.
196
  data_updated = pd.DataFrame(columns = data.columns)
197
  new_ind =0
198
+
 
199
  for i in data.index:
200
  uniprotID = data.at[i, 'uniprotID']
201
  datapoint = data.at[i, 'datapoint']
 
252
  data_updated.at[new_ind, 'distance'] = domainDistanceModels(domStart, domEnd, coordinates, varPos)
253
  for col in UNIPROT_ANNOTATION_COLS[0:30]:
254
  allDist = []
255
+
 
256
  if (data.at[i, col] != np.NaN) & (data.at[i, col] != 'hit') & (data.at[i, col] != '[]') & (
257
  data.at[i, col] != []):
258
  annots_list = ast.literal_eval(data.at[i, col])
 
274
  data_updated.at[new_ind, col] = np.NaN
275
 
276
  new_ind +=1
277
+
 
278
  data_updated = selectMaxAnnot(data_updated)
279
  data_updated = data_updated.sort_values(['hitTotal', 'annotTotal'], ascending = [False, True])
280
  data_updated = data_updated.drop_duplicates(['datapoint'])
 
463
  minutes, seconds = divmod(rem, 60)
464
  print("Time passed: {:0>2}:{:0>2}:{:05.2f}".format(int(hours), int(minutes), seconds))
465
 
466
+ return final_data