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

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Module optimization_tab

Classes

OptimizationTab

ConstraintCoordinateColumns
Constants for table columns.

ConstraintCoordinateData
This class stores all data for a single constraint coordinate.

ConstraintCoordinatesDelegate
This delegate is used to validate values entered in 'target value' column.

ConstraintCoordinatesProxyModel
A proxy model that allows to hide columns.

ConstraintCoordinatesModel
A model to store scan tab coordinates data.

Variables

maestro = schrodinger.get_maestro()

markers = None
hash(x)

COORDINATE_TYPES = OrderedDict((("Cartesian - X", mm.MMJAG_COO...

Variables Details

COORDINATE_TYPES

Value:

OrderedDict((("Cartesian - X", mm.MMJAG_COORD_CART_X), ("Cartesian - Y
", mm.MMJAG_COORD_CART_Y), ("Cartesian - Z", mm.MMJAG_COORD_CART_Z), (
"Cartesian - XYZ", mm.MMJAG_COORD_CART_XYZ), ("Distance", mm.MMJAG_COO
RD_DISTANCE), ("Angle", mm.MMJAG_COORD_ANGLE), ("Dihedral", mm.MMJAG_C
OORD_TORSION)))