Gromacs
2020-beta2
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This is the complete list of members for gmx::ModularSimulator, including all inherited members.
constr (defined in gmx::ISimulator) | gmx::ISimulator | protected |
cr (defined in gmx::ISimulator) | gmx::ISimulator | protected |
deform (defined in gmx::ISimulator) | gmx::ISimulator | protected |
doRerun (defined in gmx::ISimulator) | gmx::ISimulator | protected |
ekind (defined in gmx::ISimulator) | gmx::ISimulator | protected |
enerd (defined in gmx::ISimulator) | gmx::ISimulator | protected |
enforcedRotation (defined in gmx::ISimulator) | gmx::ISimulator | protected |
fcd (defined in gmx::ISimulator) | gmx::ISimulator | protected |
fnm (defined in gmx::ISimulator) | gmx::ISimulator | protected |
fplog (defined in gmx::ISimulator) | gmx::ISimulator | protected |
fr (defined in gmx::ISimulator) | gmx::ISimulator | protected |
imdSession (defined in gmx::ISimulator) | gmx::ISimulator | protected |
inputrec (defined in gmx::ISimulator) | gmx::ISimulator | protected |
ISimulator(FILE *fplog, t_commrec *cr, const gmx_multisim_t *ms, const MDLogger &mdlog, int nfile, const t_filenm *fnm, const gmx_output_env_t *oenv, const MdrunOptions &mdrunOptions, StartingBehavior startingBehavior, gmx_vsite_t *vsite, Constraints *constr, gmx_enfrot *enforcedRotation, BoxDeformation *deform, IMDOutputProvider *outputProvider, const MdModulesNotifier &mdModulesNotifier, t_inputrec *inputrec, ImdSession *imdSession, pull_t *pull_work, t_swap *swap, gmx_mtop_t *top_global, t_fcdata *fcd, t_state *state_global, ObservablesHistory *observablesHistory, MDAtoms *mdAtoms, t_nrnb *nrnb, gmx_wallcycle *wcycle, t_forcerec *fr, gmx_enerdata_t *enerd, gmx_ekindata_t *ekind, MdrunScheduleWorkload *runScheduleWork, const ReplicaExchangeParameters &replExParams, gmx_membed_t *membed, gmx_walltime_accounting *walltime_accounting, std::unique_ptr< StopHandlerBuilder > stopHandlerBuilder, bool doRerun) (defined in gmx::ISimulator) | gmx::ISimulator | inline |
isInputCompatible(bool exitOnFailure, const t_inputrec *inputrec, bool doRerun, const gmx_vsite_t *vsite, const gmx_multisim_t *ms, const ReplicaExchangeParameters &replExParams, const t_fcdata *fcd, int nfile, const t_filenm *fnm, ObservablesHistory *observablesHistory, const gmx_membed_t *membed) | gmx::ModularSimulator | static |
mdAtoms (defined in gmx::ISimulator) | gmx::ISimulator | protected |
mdlog (defined in gmx::ISimulator) | gmx::ISimulator | protected |
mdModulesNotifier (defined in gmx::ISimulator) | gmx::ISimulator | protected |
mdrunOptions (defined in gmx::ISimulator) | gmx::ISimulator | protected |
membed (defined in gmx::ISimulator) | gmx::ISimulator | protected |
ms (defined in gmx::ISimulator) | gmx::ISimulator | protected |
nfile (defined in gmx::ISimulator) | gmx::ISimulator | protected |
nrnb (defined in gmx::ISimulator) | gmx::ISimulator | protected |
observablesHistory (defined in gmx::ISimulator) | gmx::ISimulator | protected |
oenv (defined in gmx::ISimulator) | gmx::ISimulator | protected |
outputProvider (defined in gmx::ISimulator) | gmx::ISimulator | protected |
pull_work (defined in gmx::ISimulator) | gmx::ISimulator | protected |
replExParams (defined in gmx::ISimulator) | gmx::ISimulator | protected |
run() override | gmx::ModularSimulator | |
runScheduleWork (defined in gmx::ISimulator) | gmx::ISimulator | protected |
SimulatorBuilder (defined in gmx::ModularSimulator) | gmx::ModularSimulator | friend |
startingBehavior (defined in gmx::ISimulator) | gmx::ISimulator | protected |
state_global (defined in gmx::ISimulator) | gmx::ISimulator | protected |
stopHandlerBuilder (defined in gmx::ISimulator) | gmx::ISimulator | protected |
swap (defined in gmx::ISimulator) | gmx::ISimulator | protected |
top_global (defined in gmx::ISimulator) | gmx::ISimulator | protected |
vsite (defined in gmx::ISimulator) | gmx::ISimulator | protected |
walltime_accounting (defined in gmx::ISimulator) | gmx::ISimulator | protected |
wcycle (defined in gmx::ISimulator) | gmx::ISimulator | protected |
~ISimulator()=default (defined in gmx::ISimulator) | gmx::ISimulator | virtual |