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Use other example for thermo_style multi test

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This commit is contained in:
Richard Berger
2021-03-08 18:15:43 -05:00
parent 83fddb1123
commit 728b4801fd
1 changed files with 5 additions and 7 deletions
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12
unittest/python/python-formats.py
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@ -5,7 +5,7 @@ from lammps.formats import LogFile, AvgChunkFile
EXAMPLES_DIR=os.path.abspath(os.path.join(__file__, '..', '..', '..', 'examples'))
DEFAULT_STYLE_EXAMPLE_LOG="melt/log.27Nov18.melt.g++.1"
MULTI_STYLE_EXAMPLE_LOG="USER/fep/CC-CO/fep10/log.lammps"
MULTI_STYLE_EXAMPLE_LOG="peptide/log.27Nov18.peptide.g++.1"
AVG_CHUNK_FILE="VISCOSITY/profile.13Oct16.nemd.2d.g++.1"
class Logfiles(unittest.TestCase):
@ -34,11 +34,10 @@ class Logfiles(unittest.TestCase):
def testMultiLogFile(self):
log = LogFile(os.path.join(EXAMPLES_DIR, MULTI_STYLE_EXAMPLE_LOG))
self.assertEqual(len(log.runs), 2)
self.assertEqual(len(log.runs), 1)
run0 = log.runs[0]
run1 = log.runs[1]
self.assertEqual(len(run0.keys()), 15)
self.assertEqual(len(run0.keys()), 14)
self.assertIn("Step", run0)
self.assertIn("CPU", run0)
self.assertIn("TotEng", run0)
@ -53,12 +52,11 @@ class Logfiles(unittest.TestCase):
self.assertIn("E_coul", run0)
self.assertIn("E_long", run0)
self.assertIn("Press", run0)
self.assertIn("Volume", run0)
for k in run0:
self.assertEqual(len(run0[k]), 51)
self.assertEqual(len(run0[k]), 7)
self.assertEqual(run0["Step"], list(range(0,255000, 5000)))
self.assertEqual(run0["Step"], list(range(0,350, 50)))
class AvgChunkFiles(unittest.TestCase):