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root/group/trunk/OOPSE-2.0/src/io/Globals.hpp
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Comparing trunk/OOPSE-2.0/src/io/Globals.hpp (file contents):
Revision 2235 by tim, Thu May 19 21:31:23 2005 UTC vs.
Revision 2285 by gezelter, Wed Sep 7 20:46:46 2005 UTC

# Line 132 | Line 132 | class Globals{
132    int    getMinLSMaxIter(void)      { return minimizer_ls_maxiteration; }
133    int    getUseSolidThermInt(void)  { return useSolidThermInt; }
134    int    getUseLiquidThermInt(void) { return useLiquidThermInt; }
135 <  double getThermIntLambda(void)   { return thermodynamic_integration_lambda; }
135 >  double getThermIntLambda(void)    { return thermodynamic_integration_lambda; }
136    double getThermIntK(void)         { return thermodynamic_integration_k; }
137    char*  getForceFieldVariant( void ) { return forcefield_variant; }
138 <  char* getForceFieldFileName() { return forcefield_filename;}
138 >  char*  getForceFieldFileName()    { return forcefield_filename; }
139    double getDistSpringConst(void)   { return therm_int_dist_spring; }
140    double getThetaSpringConst(void)  { return therm_int_theta_spring; }
141    double getOmegaSpringConst(void)  { return therm_int_omega_spring; }
142 <  double getSurfaceTension(void) {return surface_tension; }
142 >  double getSurfaceTension(void)    { return surface_tension; }
143 >  bool   getPrintPressureTensor(void) { return print_pressure_tensor;}
144 >  bool   getUseUndampedWolf(void)   { return useUndampedWolf; }
145 >  bool   getUseDampedWolf(void)     { return useDampedWolf; }
146 >  char*  getCutoffPolicy(void)      { return cutoffPolicy; }
147    
148    short int haveDt( void )            { return have_dt; }
149    short int haveRunTime( void )       { return have_run_time; }
# Line 183 | Line 187 | class Globals{
187    short int haveMinLSMaxIter(void)    { return have_minimizer_ls_maxiteration;}
188    short int haveThermIntLambda(void)  { return have_thermodynamic_integration_lambda; }
189    short int haveThermIntK(void)    { return have_thermodynamic_integration_k; }
190 <  short int haveForceFieldVariant(void) { return have_forcefield_variant; }
190 >  short int haveForceFieldVariant(void)  { return have_forcefield_variant; }
191    short int haveForceFieldFileName(void) { return have_forcefield_filename; }
192 <  short int haveDistSpringConst(void) { return have_dist_spring_constant; }
193 <  short int haveThetaSpringConst(void) { return have_theta_spring_constant; }
194 <  short int haveOmegaSpringConst(void) { return have_omega_spring_constant; }
195 <  short int haveSurfaceTension(void) { return have_surface_tension; }
192 >  short int haveDistSpringConst(void)    { return have_dist_spring_constant; }
193 >  short int haveThetaSpringConst(void)   { return have_theta_spring_constant; }
194 >  short int haveOmegaSpringConst(void)   { return have_omega_spring_constant; }
195 >  short int haveSurfaceTension(void)     { return have_surface_tension; }
196 >  short int havePrintPressureTensor(void) {return have_print_pressure_tensor;}
197 >  short int haveCutoffPolicy(void)       { return have_cutoff_policy; }
198 >
199    /* other accessors */
200    Component** getComponents( void )   { return components; }
201    ZconStamp** getZconStamp( void )    { return zConstraints; }
# Line 265 | Line 272 | class Globals{
272    double therm_int_theta_spring;
273    double therm_int_omega_spring;
274    double surface_tension;
275 +  bool print_pressure_tensor;
276 +  bool useUndampedWolf;
277 +  bool useDampedWolf;
278 +  char cutoffPolicy[100];
279    
280    //required arguments
281    short int have_force_field, have_n_components, have_target_temp;
# Line 293 | Line 304 | class Globals{
304    short int have_theta_spring_constant;
305    short int have_omega_spring_constant;
306    short int have_surface_tension;
307 +  short int have_print_pressure_tensor;
308 +  short int have_cutoff_policy;
309   };
310  
311   #endif

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