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various.h

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/* 
// File:    various.h 
//
// Purpose:  
//   Macros for constants program parameters

#ifndef _VARIOUS_H_
#define _VARIOUS_H_ 

#include "maloc/maloc.h"
#include "apbs/apbs.h"

#define COULOMB_FACTOR(eps_w) (Vunit_ec*Vunit_ec/(4.0*1.0e-10*Vunit_pi*Vunit_eps0*eps_w))
                                                                                                        
#define EPS_W   78.36           

#define MAX_DISPL 2.0   

#define MIN_P_NUMBER 11.0                               

/*fixed program parameters*/
#define MAX_PROBE_RAD 5.0                                       

#define MIN_ION_RAD 1.5         

#define VOLUME_CALC_RES 1.0                                             

#define VACCMAXNBOR 20

/*control macros*/
#ifndef VDEBUG

#define _TWISTER_INLINES_ 1

#define _ANALYSIS_INLINES_ 1

#define _SSYSTEM_INLINES_ 1

#define _PARAMS_INLINES_ 1

#define _MACROMOLECULE_INLINES_ 1

#define _IONLIST_INLINES_ 1

#define _ENERGY_INLINES_ 1

#endif /* ifndef DEBUG */



#endif /* ifndef _VARIOUS_H_ */

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