ComputedIntValues¶

class pylimer_tools_cpp.ComputedIntValues(self: pylimer_tools_cpp.ComputedIntValues, value: int)¶

Bases: pybind11_object

Integer output quantities

Members:

STEP : Results in the output column “Step”.

NUM_SHIFT : Results in the output column “numShift”.

NUM_RELOC : Results in the output column “numReloc”.

NUM_ATOMS : Results in the output column “numAtoms”.

NUM_EXTRA_ATOMS : Results in the output column “numExtraAtoms”.

NUM_BONDS : Results in the output column “numBonds”.

NUM_EXTRA_BONDS : Results in the output column “numExtraBonds”.

NUM_BONDS_TO_FORM : Results in the output column “numBondsToForm”.

Attributes Summary

`NUM_ATOMS`
`NUM_BONDS`
`NUM_BONDS_TO_FORM`
`NUM_EXTRA_ATOMS`
`NUM_EXTRA_BONDS`
`NUM_RELOC`
`NUM_SHIFT`
`STEP`
`name`
`value`

Attributes Documentation

NUM_ATOMS = <ComputedIntValues.NUM_ATOMS: 3>¶

NUM_BONDS = <ComputedIntValues.NUM_BONDS: 5>¶

NUM_BONDS_TO_FORM = <ComputedIntValues.NUM_BONDS_TO_FORM: 7>¶

NUM_EXTRA_ATOMS = <ComputedIntValues.NUM_EXTRA_ATOMS: 4>¶

NUM_EXTRA_BONDS = <ComputedIntValues.NUM_EXTRA_BONDS: 6>¶

NUM_RELOC = <ComputedIntValues.NUM_RELOC: 2>¶

NUM_SHIFT = <ComputedIntValues.NUM_SHIFT: 1>¶

STEP = <ComputedIntValues.STEP: 0>¶

name¶

value¶