NAMD
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#include <common.h>
Public Member Functions | |
dcd_params () | |
Public Attributes | |
uint16 | tag |
char | inputFilename [NAMD_FILENAME_BUFFER_SIZE] |
char | outFilename [NAMD_FILENAME_BUFFER_SIZE] |
int | frequency |
OUTPUTFILETYPE | type |
std::vector< int32 > | dcdSelectionIndex |
std::vector< int32 > | dcdSelectionIndexReverse |
int | size |
int | localSize |
off_t | dcdOffset |
std::vector<int32> dcd_params::dcdSelectionIndex |
Definition at line 257 of file common.h.
Referenced by Molecule::get_atom_index_from_dcd_selection().
std::vector<int32> dcd_params::dcdSelectionIndexReverse |
Definition at line 258 of file common.h.
Referenced by Molecule::get_dcd_selection_index_from_atom_id().
int dcd_params::frequency |
Definition at line 255 of file common.h.
Referenced by SimParameters::close_dcdfile(), Output::coordinate(), Output::coordinateNeeded(), Sequencer::integrate_SOA(), NamdState::loadStructure(), ParallelIOMgr::recvDcdParams(), and ParallelIOMgr::sendDcdParams().
char dcd_params::inputFilename[NAMD_FILENAME_BUFFER_SIZE] |
Definition at line 253 of file common.h.
Referenced by ParallelIOMgr::readInfoForParOutDcdSelection(), ParallelIOMgr::recvDcdParams(), and ParallelIOMgr::sendDcdParams().
char dcd_params::outFilename[NAMD_FILENAME_BUFFER_SIZE] |
Definition at line 254 of file common.h.
Referenced by ParallelIOMgr::recvDcdParams(), and ParallelIOMgr::sendDcdParams().
int dcd_params::size |
Definition at line 259 of file common.h.
Referenced by Output::coordinate(), Molecule::get_dcd_selection_size(), and ParallelIOMgr::readInfoForParOutDcdSelection().
uint16 dcd_params::tag |
Definition at line 252 of file common.h.
Referenced by SimParameters::close_dcdfile(), Output::coordinate(), Output::coordinateNeeded(), ParallelIOMgr::recvDcdParams(), and ParallelIOMgr::sendDcdParams().
OUTPUTFILETYPE dcd_params::type |
Definition at line 256 of file common.h.
Referenced by ParallelIOMgr::recvDcdParams(), and ParallelIOMgr::sendDcdParams().