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Gromacs
2025.3
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#include <gromacs/mdrun/simulatorbuilder.h>
Collection of environmental information for a simulation.
Public Member Functions | |
| SimulatorEnv (FILE *fplog, t_commrec *commRec, gmx_multisim_t *multisimCommRec, const MDLogger &logger, gmx_output_env_t *outputEnv, ObservablesReducerBuilder *observablesReducerBuilder) | |
| Build from current simulation environment. | |
Public Attributes | |
| FILE * | fplog_ |
| Handle to log file. | |
| t_commrec * | commRec_ |
| Handle to communication record. | |
| const gmx_multisim_t * | multisimCommRec_ |
| Handle to multisim communication record. | |
| const MDLogger & | logger_ |
| Handle to propper logging framework. | |
| const gmx_output_env_t * | outputEnv_ |
| Handle to file output handling. | |
| ObservablesReducerBuilder * | observablesReducerBuilder_ |
| Builder for coordinator of reduction for observables. | |
1.8.5