示例#1
0
def test_atomic_weight():
    feq_(atomic_weight('H'), 1.00794)
    npeq_(atomic_weight(['O', 'H', 'H']), [15.9994, 1.00794, 1.00794])
示例#2
0
def test_vdw_radius():
    feq_(vdw_radius('H'), 0.11)
    npeq_(vdw_radius(['O', 'H', 'H']), [0.152, 0.11, 0.11])
示例#3
0
def test_vdw_radius():
    feq_(vdw_radius('H'), 0.11)
    npeq_(vdw_radius(['O', 'H', 'H']), [0.152, 0.11, 0.11])
示例#4
0
def test_atomic_weight():
    feq_(atomic_weight('H'), 1.00794)
    npeq_(atomic_weight(['O', 'H', 'H']), [15.9994, 1.00794, 1.00794])