task.results_text=text
+
if task.md_pdbref and task.type=='remd':
for i in range(1,6):
elif i==5:
task.remd_model5=' '.join(line.split()[-6:])
+ if task.type=='remd':
+ with open('file_cluster_clust.out_000', 'r') as f:
+
+ for line in f:
+ if 'sumprob' in line:
+ i=0
+ for line1 in f:
+ i+=1
+ if i>6:
+ break
+ if i==1:
+ task.remd_model1=task.remd_model1+'Cluster1 probability= '+line1.split()[2]
+ elif i==2:
+ task.remd_model2=task.remd_model2+'Cluster2 probability= '+line1.split()[2]
+ elif i==3:
+ task.remd_model3=task.remd_model3+'Cluster3 probability= '+line1.split()[2]
+ elif i==4:
+ task.remd_model4=task.remd_model4+'Cluster4 probability= '+line1.split()[2]
+ elif i==5:
+ task.remd_model5=task.remd_model5+'Cluster5 probability= '+line1.split()[2]
+
+
task.save()
elif os.path.isfile(task.jobdirname+'/file_GB000.stat') and not task.done: