def clean_enhc(iter_index):
iter_name = make_iter_name (iter_index)
work_path = iter_name + "/" + enhc_name + "/"
all_task = glob.glob(work_path + "/[0-9]*[0-9]")
all_task.sort()
cleaned_files = ['state*.cpt', '*log', 'traj.trr', 'topol.tpr', 'ener.edr', 'mdout.mdp']
cwd = os.getcwd()
for ii in all_task :
os.chdir(ii)
clean_files(cleaned_files)
os.chdir(cwd)
def clean_enhc(iter_index):
iter_name = make_iter_name(iter_index)
work_path = iter_name + "/" + enhc_name + "/"
all_task = glob.glob(work_path + "/[0-9]*[0-9]")
all_task.sort()
all_task += glob.glob(work_path + "/*_job_id")
all_task += glob.glob(work_path + "/*_finished")
all_task += glob.glob(work_path + "/*.sub")
all_task += glob.glob(work_path + "/*.json")
all_task += glob.glob(work_path + "/*.sub.o*")
cleaned_files = [
'state*.cpt', '*log', 'traj.trr', 'topol.tpr', 'ener.edr', 'mdout.mdp'
]
cwd = os.getcwd()
for ii in all_task:
if os.path.isdir(ii):
os.chdir(ii)
clean_files(cleaned_files)
os.chdir(cwd)
elif os.path.isfile(ii):
os.remove(ii)
print('enhanc clean done')