schrodinger.forcefield.constants module

Copyright Schrodinger, LLC. All rights reserved.

Module of constants commonly used in force field python software, which includes the ffbuilder components.

class schrodinger.forcefield.constants.GeometryOptMethod(value)

Bases: enum.Enum

An enumeration.

DFT = 'DFT'

ANN = 'QRNN'

DEFAULT = 'QRNN'