Package schrodinger :: Package application :: Package jaguar :: Package gui :: Package tabs :: Module coordinates

Module coordinates

Classes

CoordinateTab
A parent class for the Scan and Optimization tabs

CoordinatePicker
This class is responsible for atom and bond picking.

CoordinateData
This class is a base class for constraint and scan coordinate classes.

CoordinatesModel
A base class for cordinates models used for constraint and scan coordinates in Scan and Optimization tabs.

Variables

[hide private]

maestro = schrodinger.get_maestro()

markers = None
hash(x)

PICK_ATOMS = ["Atoms"]

PICK_ATOMS_AND_BONDS = ["Atoms", "Bonds"]

PICK_TYPES = OrderedDict(((mm.MMJAG_COORD_CART_X, ("x", PICK_A...

COORD_TYPES = {mm.MMJAG_COORD_CART_X, mm.MMJAG_COORD_CART_Y, m...

Variables Details

[hide private]

PICK_TYPES

Value:

OrderedDict(((mm.MMJAG_COORD_CART_X, ("x", PICK_ATOMS, 1)), (mm.MMJAG_
COORD_CART_Y, ("y", PICK_ATOMS, 1)), (mm.MMJAG_COORD_CART_Z, ("z", PIC
K_ATOMS, 1)), (mm.MMJAG_COORD_CART_XYZ, ("xyz", PICK_ATOMS, 1)), (mm.M
MJAG_COORD_DISTANCE, ("distance", PICK_ATOMS_AND_BONDS, 2)), (mm.MMJAG
_COORD_ANGLE, ("angle", PICK_ATOMS_AND_BONDS, 3)), (mm.MMJAG_COORD_TOR
SION, ("dihedral", PICK_ATOMS_AND_BONDS, 4))))

COORD_TYPES

Value:

{mm.MMJAG_COORD_CART_X, mm.MMJAG_COORD_CART_Y, mm.MMJAG_COORD_CART_Z, 
mm.MMJAG_COORD_CART_XYZ}