wuxing0105's picture
Upload folder using huggingface_hub
8efb4bd verified
Raw History Blame Contribute Delete
1.07 kB
#include "Particle.h"
#include "PDB.h"
Particle::Particle(): pos() {};
Particle::Particle(const Vector3& newPos) : pos(newPos) {};
Particle::Particle(const char* const PDBrec) :
pos(PDB::atomXCoord(PDBrec),
PDB::atomYCoord(PDBrec),
PDB::atomZCoord(PDBrec)) {}
Vector3 Particle::position() const {
return pos;
}
void Particle::moveto(const Vector3 &v) {
pos=v;
}
Particle::operator Vector3() const {
return pos;
}
Particle::operator const Vector3&() const
{
return pos;
}
Particle& Particle::operator*=(const Matrix3& lt) {
pos = lt*pos;
return *this;
}
Particle& Particle::operator*=(const RigidTrans3& rt) {
pos = rt*pos;
return *this;
}
Particle& Particle::operator+=(const Vector3 &v) {
pos+=v;
return *this;
}
Particle& Particle::operator-=(const Vector3 &v) {
pos-=v;
return *this;
}
Particle& Particle::operator*=(const float &m) {
pos*=m;
return *this;
}
Particle& Particle::operator/=(const float &m) {
pos/=m;
return *this;
}