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add local extract_compute() tests

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Axel Kohlmeyer
2022-06-20 23:07:01 -04:00
parent 033af0c507
commit ec46510d2e
1 changed files with 11 additions and 1 deletions
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12
unittest/python/python-commands.py
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@ -1,6 +1,8 @@
import sys,os,unittest,ctypes
from lammps import lammps, LMP_VAR_ATOM, LMP_STYLE_GLOBAL, LMP_TYPE_VECTOR, LAMMPS_DOUBLE_2D, LAMMPS_AUTODETECT
from lammps import lammps, LMP_VAR_ATOM, LMP_STYLE_GLOBAL, LMP_STYLE_LOCAL
from lammps import LMP_TYPE_VECTOR, LMP_SIZE_VECTOR, LMP_SIZE_ROWS, LMP_SIZE_COLS
from lammps import LAMMPS_DOUBLE_2D, LAMMPS_AUTODETECT
has_manybody=False
try:
@ -311,6 +313,14 @@ create_atoms 1 single &
self.assertEqual(minval,1.0)
self.assertEqual(maxval,2.1)
ndist1 = self.lmp.extract_compute("dist",LMP_STYLE_LOCAL,LMP_SIZE_VECTOR)
ndist2 = self.lmp.extract_compute("dist",LMP_STYLE_LOCAL,LMP_SIZE_ROWS)
ndist3 = self.lmp.extract_compute("dist",LMP_STYLE_LOCAL,LMP_SIZE_COLS)
self.assertEqual(ndist1,21)
self.assertEqual(ndist2,21)
self.assertEqual(ndist3,0)
self.assertNotEqual(self.lmp.find_pair_neighlist("lj/cut"),-1)
self.assertNotEqual(self.lmp.find_compute_neighlist("dist"),-1)
self.assertEqual(self.lmp.find_compute_neighlist("xxx"),-1)