if args.structures is None:
print('no inputs specified, please run ccCalc before')
exit()
else:
#Run ccCalc with initial args list
hklin = " ".join(str(x) for x in args.structures)
C = subprocess.Popen('ccCalc -f %s' % (hklin), cwd=os.getcwd())
#C = subprocess.Popen('/opt/pxsoft/bin/ccCalc', '-h',cwd=os.getcwd())
correlationFile = ('ccCluster_log.txt')
else:
correlationFile = args.DISTfile
CC = Clustering(correlationFile)
Tree = CC.avgTree()
etiquets = CC.createLabels()
threshold = CC.thrEstimation()
#define Class for gui main window
#tabs for result and summary are generated
#through different modules
try:
_fromUtf8 = QtCore.QString.fromUtf8
except AttributeError:
def _fromUtf8(s):
return s
try:
_encoding = QtGui.QApplication.UnicodeUTF8
