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dcdfort
Modern Fortran library for analyzing DCD trajectories
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Data Types | |
| type | dcdfort_writer::dcdwriter |
| dcdwriter class More... | |
Modules | |
| module | dcdfort_writer |
| Module that contains dcdwriter class. | |
Functions/Subroutines | |
| subroutine | dcdfort_writer::dcdwriter_open (this, filename) |
| Opens new file to write to. More... | |
| subroutine | dcdfort_writer::dcdwriter_write_header (this, istart, nevery, timestep, natoms) |
| Writes header to new DCD file. More... | |
| subroutine | dcdfort_writer::dcdwriter_close (this) |
| Closes DCD file. More... | |
| subroutine | dcdfort_writer::dcdwriter_write_next (this, xyz, box_in) |
| Writes snapshot to an open DCD file. More... | |
1.8.13