Package schrodinger :: Package application :: Package desmond :: Module cms :: Class Constraint

Class Constraint

object --+
         |
        Constraint

Instance Methods

[hide private]

__init__(self, func, atom_i=0, atom_j=0, atom_k=0, atom_l=0, atom_m=0, c1=0, c2=0, c3=0, c4=0, c5=0, c6=0)
x.__init__(...) initializes x; see help(type(x)) for signature

num_constraint(self)

Inherited from object: __delattr__, __format__, __getattribute__, __hash__, __new__, __reduce__, __reduce_ex__, __repr__, __setattr__, __sizeof__, __str__, __subclasshook__

Class Variables

[hide private]

NUM_CONSTRAINT = {'AH1': 1, 'AH2': 2, 'AH3': 3, 'AH4': 4, 'AH5...

Properties

[hide private]

Inherited from object: __class__

Method Details

[hide private]

init(self, func, atom_i=0, atom_j=0, atom_k=0, atom_l=0, atom_m=0, c1=0, c2=0, c3=0, c4=0, c5=0, c6=0)
(Constructor)

x.__init__(...) initializes x; see help(type(x)) for signature

Overrides: object.__init__

Class Variable Details

[hide private]

NUM_CONSTRAINT

Value:

{'AH1': 1, 'AH2': 2, 'AH3': 3, 'AH4': 4, 'AH5': 5, 'HOH': 3}

Class Constraint

__init__(self, func, atom_i=0, atom_j=0, atom_k=0, atom_l=0, atom_m=0, c1=0, c2=0, c3=0, c4=0, c5=0, c6=0) (Constructor)

NUM_CONSTRAINT

init(self, func, atom_i=0, atom_j=0, atom_k=0, atom_l=0, atom_m=0, c1=0, c2=0, c3=0, c4=0, c5=0, c6=0)
(Constructor)