def test_BondElementBondSelector_select_all_bnds(self):
"""
test BondElement select: all bonds
"""
bndSel = BondElementBondSelector('C')
ats = self.mol.allAtoms
bnds = ats.bonds[0]
resultBnds = bndSel.select(bnds)
#print 'all_bnds:len(resultBnds)=', len(resultBnds)
self.assertEqual(len(resultBnds) , 334)
def test_BondElementBondSelector_select_all_bnds(self):
"""
test BondElement select: all bonds
"""
bndSel = BondElementBondSelector('C')
ats = self.mol.allAtoms
bnds = ats.bonds[0]
resultBnds = bndSel.select(bnds)
#print 'all_bnds:len(resultBnds)=', len(resultBnds)
self.assertEqual(len(resultBnds), 334)
def test_BondElementBondSelector_select_no_bnds(self):
"""
test BondElement select: no bonds
"""
bndSel = BondElementBondSelector("P")
ats = self.mol.allAtoms
bnds = ats.bonds[0]
resultBnds = bndSel.select(bnds)
# print 'no_bnds:len(resultBnds)=', len(resultBnds)
self.assertEqual(len(resultBnds), 0)
def test_BondElementBondSelector_select_some_bnds(self):
"""
test BondElement select: some bonds
"""
bndSel = BondElementBondSelector('C')
ats = self.mol.allAtoms[:10]
bnds = ats.bonds[0]
resultBnds = bndSel.select(bnds)
#print 'some_bnds:len(resultBnds)=', len(resultBnds)
#self.assertEqual(len(resultBnds) , 9)
self.assertEqual(len(resultBnds) , 6)
def test_BondElementBondSelector_select_some_bnds(self):
"""
test BondElement select: some bonds
"""
bndSel = BondElementBondSelector('C')
ats = self.mol.allAtoms[:10]
bnds = ats.bonds[0]
resultBnds = bndSel.select(bnds)
#print 'some_bnds:len(resultBnds)=', len(resultBnds)
#self.assertEqual(len(resultBnds) , 9)
self.assertEqual(len(resultBnds), 6)
def test_BondElementBondSelector_constructor(self):
"""
test BondElement constructor
"""
bndLenSel = BondElementBondSelector('C')
self.assertEqual(bndLenSel.__class__, BondElementBondSelector)