import os, re, subprocess, unittest # enable test mode os.putenv('LAMMPS_SHELL_TESTING','1') shell_prompt_re = r"([^>]*LAMMPS Shell> ([a-z0-9_]+) *([a-z0-9_\.]+)?.*\n)+" cmd_group_re = r"([^>]*LAMMPS Shell> ([a-z0-9_]+) +([a-z0-9]+) +([a-z0-9]+)? *([a-z/0-9]+)?.*\n)+" # class LammpsShell(unittest.TestCase): def setUp(self): self.proc = subprocess.Popen('./lammps-shell', stdin=subprocess.PIPE, stdout=subprocess.PIPE) def tearDown(self): self.proc.kill() def InputRunner(self,text): """Test tab expansions""" try: [outs,errs] = self.proc.communicate(input=text, timeout=10) self.timeout = 0 except subprocess.TimeoutExpired: self.proc.kill() [outs,errs] = self.proc.communicate() self.timeout = 1 return outs.decode('UTF-8') def testExpandClearHistory(self): """Test expansion of a shell specific command""" matches = re.findall(shell_prompt_re, self.InputRunner(b'clear_his\t\n'), re.MULTILINE) if self.timeout: self.fail("Timeout") else: self.assertEqual(matches[0][1],"clear_history") def testExpandDimension(self): """Test expansion of a LAMMPS command""" matches = re.findall(shell_prompt_re, self.InputRunner(b'dimens\t\n'), re.MULTILINE) if self.timeout: self.fail("Timeout") else: self.assertEqual(matches[0][1],"dimension") def testExpandPairStyle(self): """Test expansion of a pair style""" matches = re.findall(shell_prompt_re, self.InputRunner(b'pair_st\t zer\t\n'), re.MULTILINE) if self.timeout: self.fail("Timeout") else: self.assertEqual(matches[0][1],"pair_style") self.assertEqual(matches[0][2],"zero") def testExpandBondStyle(self): """Test expansion of a bond style""" matches = re.findall(shell_prompt_re, self.InputRunner(b'bond_st\t zer\t\n'), re.MULTILINE) if self.timeout: self.fail("Timeout") else: self.assertEqual(matches[0][1],"bond_style") self.assertEqual(matches[0][2],"zero") def testExpandAngleStyle(self): """Test expansion of a angle style""" matches = re.findall(shell_prompt_re, self.InputRunner(b'angle_st\t zer\t\n'), re.MULTILINE) if self.timeout: self.fail("Timeout") else: self.assertEqual(matches[0][1],"angle_style") self.assertEqual(matches[0][2],"zero") def testExpandDihedralStyle(self): """Test expansion of a dihedral style""" matches = re.findall(shell_prompt_re, self.InputRunner(b'dihedral_st\t zer\t\n'), re.MULTILINE) if self.timeout: self.fail("Timeout") else: self.assertEqual(matches[0][1],"dihedral_style") self.assertEqual(matches[0][2],"zero") def testExpandImproperStyle(self): """Test expansion of a improper style""" matches = re.findall(shell_prompt_re, self.InputRunner(b'improper_st\t zer\t\n'), re.MULTILINE) if self.timeout: self.fail("Timeout") else: self.assertEqual(matches[0][1],"improper_style") self.assertEqual(matches[0][2],"zero") def testExpandComputeGroup(self): """Test expansion of a group-ID and a compute command""" matches = re.findall(cmd_group_re, self.InputRunner(b'compute test al\tcentro/at\t\n'), re.MULTILINE) if self.timeout: self.fail("Timeout") else: self.assertEqual(matches[0][1],"compute") self.assertEqual(matches[0][2],"test") self.assertEqual(matches[0][3],"all") self.assertEqual(matches[0][4],"centro/atom") def testExpandFixGroup(self): """Test expansion of a group-ID and a fix command""" matches = re.findall(cmd_group_re, self.InputRunner(b'fix test al\tcontroll\t\n'), re.MULTILINE) if self.timeout: self.fail("Timeout") else: self.assertEqual(matches[0][1],"fix") self.assertEqual(matches[0][2],"test") self.assertEqual(matches[0][3],"all") self.assertEqual(matches[0][4],"controller") def testExpandSource(self): """Test expansion of a shell command and a file name""" with open('.tmp.in.source', 'w') as out: print('units real', file=out) out.close() matches = re.findall(shell_prompt_re, self.InputRunner(b'sour\t.tmp.in.sou\t\n'), re.MULTILINE) os.remove('.tmp.in.source') if self.timeout: self.fail("Timeout") else: self.assertEqual(matches[0][1],"source") self.assertEqual(matches[0][2],".tmp.in.source") def testHistory(self): """Test history expansion""" out = self.InputRunner(b'clear_history\nunits real\ndimension 2\n!!:p\n!-3:p\n!dim:p\n!uni:p\nprint !!:$\nprint !dim:1\n') idx = 0 if self.timeout: self.fail("Timeout") else: lines = out.splitlines() for line in lines: if line.startswith('LAMMPS Shell>'): break idx += 1 self.assertEqual(lines[idx+4],"dimension 2") self.assertEqual(lines[idx+6],"units real") self.assertEqual(lines[idx+8],"dimension 2") self.assertEqual(lines[idx+10],"units real") self.assertEqual(lines[idx+12],"real") self.assertEqual(lines[idx+14],"2") ########################### if __name__ == "__main__": unittest.main()