Chemical Data Processing Library C++ API - Version 1.1.1
Variables
CDPL::ForceField::InteractionType Namespace Reference

Provides flags for the specification of a set of force field interaction types. More...

Variables

const unsigned int NONE = 0x00
 
const unsigned int BOND_STRETCHING = 0x01
 
const unsigned int ANGLE_BENDING = 0x02
 
const unsigned int STRETCH_BEND = 0x04
 
const unsigned int OUT_OF_PLANE_BENDING = 0x08
 
const unsigned int TORSION = 0x10
 
const unsigned int VAN_DER_WAALS = 0x20
 
const unsigned int ELECTROSTATIC = 0x40
 
const unsigned int ALL = 0x7f
 

Detailed Description

Provides flags for the specification of a set of force field interaction types.

Variable Documentation

◆ NONE

const unsigned int CDPL::ForceField::InteractionType::NONE = 0x00

◆ BOND_STRETCHING

const unsigned int CDPL::ForceField::InteractionType::BOND_STRETCHING = 0x01

◆ ANGLE_BENDING

const unsigned int CDPL::ForceField::InteractionType::ANGLE_BENDING = 0x02

◆ STRETCH_BEND

const unsigned int CDPL::ForceField::InteractionType::STRETCH_BEND = 0x04

◆ OUT_OF_PLANE_BENDING

const unsigned int CDPL::ForceField::InteractionType::OUT_OF_PLANE_BENDING = 0x08

◆ TORSION

const unsigned int CDPL::ForceField::InteractionType::TORSION = 0x10

◆ VAN_DER_WAALS

const unsigned int CDPL::ForceField::InteractionType::VAN_DER_WAALS = 0x20

◆ ELECTROSTATIC

const unsigned int CDPL::ForceField::InteractionType::ELECTROSTATIC = 0x40

◆ ALL

const unsigned int CDPL::ForceField::InteractionType::ALL = 0x7f