mdio_DcdHeader_t Struct Reference

DCD header information provided by user. More...

#include <dcd.h>

List of all members.

Public Attributes
double	timestep
int32	natoms
int32	firststep
int32	framestepcnt
int32	cellstatus

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Detailed Description

DCD header information provided by user.

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Member Data Documentation

int32 mdio_DcdHeader_t::cellstatus

Cell status flag to indicate a periodic cell.

int32 mdio_DcdHeader_t::firststep

Numbering of the first timestep.

int32 mdio_DcdHeader_t::framestepcnt

Number of steps between each frame.

int32 mdio_DcdHeader_t::natoms

Number of atoms in system.

double mdio_DcdHeader_t::timestep

Size of timestep in femtoseconds.

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

• mdio/dcd.h

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