1 import os
2 import sys
3 sys.path.insert(0, '/home/cs/pellegrini/nMOLDYN/development')
4 from nMOLDYN.Core.IOFiles import convertASCIIToNetCDF
5
6 a = 'DISFG'
7
8 pMoldyn='/home/cs/pellegrini/nMOLDYN/nMOLDYN2.2.5/nMoldyn/bin/pMoldyn'
9
10 if len(sys.argv) > 1:
11 selectedTests = [int(v) for v in sys.argv[1:]]
12 else:
13 selectedTests = range(1,13)
14
15 for i in selectedTests:
16 print "Run test ", i
17 os.system(pMoldyn + ' --isfg --input=%s%s_Reference.inp' % (a,i))
18 os.system('mv DISFG_Fqt_test.nc Fqt%s_Reference.nc' % i)
19 os.system('mv DISFG_Sqw_test.nc Sqw%s_Reference.nc' % i)
20