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| subroutine | dcdfort_trajectory::trajectory_open (this, filename, ndxfile) |
| | Trajectory class method which opens DCD file and optionally index file. More...
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| pure integer(kind=int32) function | dcdfort_trajectory::trajectory_get_natoms (this, group) |
| | Trajectory class method which gets the number of atoms in the system or an index group. More...
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| integer(kind=int32) function | dcdfort_trajectory::trajectory_skip_next (this, F) |
| | Trajectory class method which skips a specified number of frames. More...
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| integer(kind=int32) function | dcdfort_trajectory::trajectory_read_next (this, F, ndxgrp, every) |
| | Trajectory class method which reads a specified number of frames into memory after using the open() method. More...
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| pure real(kind=real32) function, dimension(3) | dcdfort_trajectory::trajectory_get_xyz (this, frame, atom, group) |
| | Trajectory class method which returns the coordinates of a particle. More...
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| subroutine | dcdfort_trajectory::trajectory_read (this, dcdfile, ndxfile, ndxgrp, every, skip, last) |
| | Trajectory class method which opens, reads, and closes a trajectory file. More...
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| pure real(kind=real64) function, dimension(6) | dcdfort_trajectory::trajectory_get_box (this, frame) |
| | Trajectory class method which returns the box from a simulation frame. More...
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| subroutine | dcdfort_trajectory::trajectory_close (this) |
| | Trajectory class method which closes a DCD file which was opened with open() More...
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| pure real(kind=real64) function | dcdfort_trajectory::trajectory_vol (this, frame) |
| | Trajectory class method which returns the volume of the box. More...
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