Add placeholders for future tests
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@ -1,5 +1,5 @@
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import sys,os,unittest
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import sys,os,unittest
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from lammps import lammps, LMP_STYLE_GLOBAL, LMP_STYLE_ATOM, LMP_TYPE_VECTOR, LMP_TYPE_SCALAR
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from lammps import lammps, LMP_STYLE_GLOBAL, LMP_STYLE_LOCAL, LMP_STYLE_ATOM, LMP_TYPE_VECTOR, LMP_TYPE_SCALAR, LMP_TYPE_ARRAY
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from ctypes import c_void_p
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from ctypes import c_void_p
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class PythonNumpy(unittest.TestCase):
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class PythonNumpy(unittest.TestCase):
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@ -15,7 +15,10 @@ class PythonNumpy(unittest.TestCase):
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def testLammpsPointer(self):
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def testLammpsPointer(self):
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self.assertEqual(type(self.lmp.lmp), c_void_p)
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self.assertEqual(type(self.lmp.lmp), c_void_p)
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def testExtractCompute(self):
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def testExtractComputeGlobalScalar(self):
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# TODO
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def testExtractComputeGlobalVector(self):
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self.lmp.command("region box block 0 2 0 2 0 2")
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self.lmp.command("region box block 0 2 0 2 0 2")
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self.lmp.command("create_box 1 box")
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self.lmp.command("create_box 1 box")
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self.lmp.command("create_atoms 1 single 1.0 1.0 1.0")
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self.lmp.command("create_atoms 1 single 1.0 1.0 1.0")
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@ -29,7 +32,10 @@ class PythonNumpy(unittest.TestCase):
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self.assertEqual(values[1], 2.0)
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self.assertEqual(values[1], 2.0)
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self.assertEqual(values[2], 2.5)
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self.assertEqual(values[2], 2.5)
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def testExtractComputePerAtom(self):
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def testExtractComputeGlobalArray(self):
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# TODO
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def testExtractComputePerAtomVector(self):
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self.lmp.command("region box block 0 2 0 2 0 2")
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self.lmp.command("region box block 0 2 0 2 0 2")
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self.lmp.command("create_box 1 box")
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self.lmp.command("create_box 1 box")
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self.lmp.command("create_atoms 1 single 1.0 1.0 1.0")
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self.lmp.command("create_atoms 1 single 1.0 1.0 1.0")
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@ -42,5 +48,17 @@ class PythonNumpy(unittest.TestCase):
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self.assertEqual(values[0], 0.0)
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self.assertEqual(values[0], 0.0)
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self.assertEqual(values[1], 0.0)
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self.assertEqual(values[1], 0.0)
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def testExtractComputePerAtomArray(self):
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# TODO
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def testExtractComputeLocalScalar(self):
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# TODO
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def testExtractComputeLocalVector(self):
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# TODO
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def testExtractComputeLocalArray(self):
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# TODO
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if __name__ == "__main__":
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if __name__ == "__main__":
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unittest.main()
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unittest.main()
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