PropagationMode.hpp File Reference

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Namespaces
namespace	PropagationMode

Enumerations
enum	PropagationMode::PropagationMode : int {   PropagationMode::NONE = 0 , PropagationMode::SYSTEM_DEFAULT = 1 << 0 , PropagationMode::TRANS_NEWTON = 1 << 1 , PropagationMode::TRANS_LANGEVIN = 1 << 2 ,   PropagationMode::TRANS_LANGEVIN_NPT = 1 << 3 , PropagationMode::TRANS_VS_RELATIVE = 1 << 4 , PropagationMode::TRANS_LB_MOMENTUM_EXCHANGE = 1 << 5 , PropagationMode::TRANS_LB_TRACER = 1 << 6 ,   PropagationMode::TRANS_BROWNIAN = 1 << 7 , PropagationMode::TRANS_STOKESIAN = 1 << 8 , PropagationMode::ROT_EULER = 1 << 10 , PropagationMode::ROT_LANGEVIN = 1 << 11 ,   PropagationMode::ROT_VS_RELATIVE = 1 << 12 , PropagationMode::ROT_BROWNIAN = 1 << 13 , PropagationMode::ROT_STOKESIAN = 1 << 14 }
	Flags to create bitmasks for propagation modes. More...
enum	IntegratorSwitch : int {   INTEG_METHOD_NPT_ISO = 0 , INTEG_METHOD_NVT = 1 , INTEG_METHOD_STEEPEST_DESCENT = 2 , INTEG_METHOD_BD = 3 ,   INTEG_METHOD_SD = 4 }
	Integrator identifier. More...
enum	ThermostatFlags : int {   THERMO_OFF = 0 , THERMO_LANGEVIN = 1 << 0 , THERMO_BROWNIAN = 1 << 1 , THERMO_NPT_ISO = 1 << 2 ,   THERMO_LB = 1 << 3 , THERMO_SD = 1 << 4 , THERMO_DPD = 1 << 5 , THERMO_BOND = 1 << 6 }
	Thermostat flags. More...

Enumeration Type Documentation

IntegratorSwitch

enum IntegratorSwitch : int

Integrator identifier.

Enumerator
INTEG_METHOD_NPT_ISO
INTEG_METHOD_NVT
INTEG_METHOD_STEEPEST_DESCENT
INTEG_METHOD_BD
INTEG_METHOD_SD

Definition at line 44 of file PropagationMode.hpp.

ThermostatFlags

enum ThermostatFlags : int

Thermostat flags.

Enumerator
THERMO_OFF
THERMO_LANGEVIN
THERMO_BROWNIAN
THERMO_NPT_ISO
THERMO_LB
THERMO_SD
THERMO_DPD
THERMO_BOND

Definition at line 53 of file PropagationMode.hpp.