ComInfo Struct Reference

Center of mass information for a molecule. More...

Public Member Functions
template<class Archive >
void	serialize (Archive &ar, unsigned int const version)

Public Attributes
double	total_mass = 0.
	Sum of the masses of all constituent particles.
Utils::Vector3d	weighted_position = {0., 0., 0.}
	Sum of (mass * position) for all constituent particles.

Friends
class	boost::serialization::access

Detailed Description

Center of mass information for a molecule.

Hold the total mass and the mass-weighted position sum for a molecule, used in center of mass calculations and MPI communication.

Definition at line 73 of file com.cpp.

Member Function Documentation

serialize()

template<class Archive >

void ComInfo::serialize ( Archive &  ar, unsigned int const  version  )

inline

Definition at line 81 of file com.cpp.

References stream, total_mass, and weighted_position.

Friends And Related Symbol Documentation

boost::serialization::access

friend class boost::serialization::access

friend

Definition at line 79 of file com.cpp.

Member Data Documentation

total_mass

double ComInfo::total_mass = 0.

Sum of the masses of all constituent particles.

Definition at line 75 of file com.cpp.

Referenced by serialize().

weighted_position

Utils::Vector3d ComInfo::weighted_position = {0., 0., 0.}

Sum of (mass * position) for all constituent particles.

Definition at line 77 of file com.cpp.

Referenced by serialize().

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The documentation for this struct was generated from the following file:

• com.cpp