1 #ifndef MCMD_LAMMPS_DUMP_READER_H 2 #define MCMD_LAMMPS_DUMP_READER_H 11 #include <mcMd/trajectory/TrajectoryReader.h> 12 #include <util/containers/DArray.h> 13 #include <util/space/Vector.h> 50 void open(std::string filename);
A set of interacting Molecules enclosed by a Boundary.
TrajectoryReader for Lammps dump trajectory files.
Utility classes for scientific computation.
Trajectory file reader (base class).
Dynamically allocatable contiguous array template.
Single-processor Monte Carlo (MC) and molecular dynamics (MD).