| 143 |
|
char* getElectrostaticSummationMethod(void) { return electrostaticSummationMethod; } |
| 144 |
|
double getDampingAlpha(void) { return dampingAlpha; } |
| 145 |
|
char* getCutoffPolicy(void) { return cutoffPolicy; } |
| 146 |
+ |
bool getCompressDumpFile(void) { return compressDumpFile;} |
| 147 |
|
|
| 148 |
|
short int haveDt( void ) { return have_dt; } |
| 149 |
|
short int haveRunTime( void ) { return have_run_time; } |
| 197 |
|
short int haveElectrostaticSummationMethod(void) {return have_electro_sum_method;} |
| 198 |
|
short int haveDampingAlpha(void) { return have_damping_alpha; } |
| 199 |
|
short int haveCutoffPolicy(void) { return have_cutoff_policy; } |
| 200 |
+ |
short int haveCompressDumpfile(void) { return have_compress_dumpfile; } |
| 201 |
|
|
| 202 |
|
/* other accessors */ |
| 203 |
|
Component** getComponents( void ) { return components; } |
| 278 |
|
char electrostaticSummationMethod[100]; |
| 279 |
|
double dampingAlpha; |
| 280 |
|
char cutoffPolicy[100]; |
| 281 |
+ |
bool compressDumpFile; |
| 282 |
|
|
| 283 |
|
//required arguments |
| 284 |
|
short int have_force_field, have_n_components, have_target_temp; |
| 311 |
|
short int have_electro_sum_method; |
| 312 |
|
short int have_damping_alpha; |
| 313 |
|
short int have_cutoff_policy; |
| 314 |
+ |
short int have_compress_dumpfile; |
| 315 |
|
}; |
| 316 |
|
|
| 317 |
|
#endif |