#include <BALL/SOLVATION/pairExpInteractionEnergyProcessor.h>
Static Public Attributes | |
static const char * | VERBOSITY |
static const char * | ALPHA |
static const char * | C1 |
static const char * | C2 |
static const char * | CLAVERIE_FILENAME |
static const char * | USE_RDF |
static const char * | RDF_FILENAME |
static const char * | SOLVENT_FILENAME |
static const char * | SURFACE_TYPE |
static const char * | SURFACE_FILENAME |
Symbolic names for option keys. This struct contains a symbolic name for each recognized key in PairExpInteractionEnergyProcessor::options.
Definition at line 79 of file pairExpInteractionEnergyProcessor.h.
const char* BALL::PairExpInteractionEnergyProcessor::Option::ALPHA [static] |
Constants for the pair potential.
alpha | float | |
c1 | float | |
c2 | float |
Definition at line 97 of file pairExpInteractionEnergyProcessor.h.
const char* BALL::PairExpInteractionEnergyProcessor::Option::C1 [static] |
Definition at line 98 of file pairExpInteractionEnergyProcessor.h.
const char* BALL::PairExpInteractionEnergyProcessor::Option::C2 [static] |
Definition at line 99 of file pairExpInteractionEnergyProcessor.h.
const char* BALL::PairExpInteractionEnergyProcessor::Option::CLAVERIE_FILENAME [static] |
Definition at line 101 of file pairExpInteractionEnergyProcessor.h.
const char* BALL::PairExpInteractionEnergyProcessor::Option::RDF_FILENAME [static] |
RDF file option. This options sets the name of the file containing the RDF information. Use char* values with this option.
rdf_file_name | char* |
Definition at line 117 of file pairExpInteractionEnergyProcessor.h.
const char* BALL::PairExpInteractionEnergyProcessor::Option::SOLVENT_FILENAME [static] |
Solvent description file option. This option sets the name of the file containig the solvent description. Use char* values with this option.
solvent_file_name | char* |
Definition at line 125 of file pairExpInteractionEnergyProcessor.h.
const char* BALL::PairExpInteractionEnergyProcessor::Option::SURFACE_FILENAME [static] |
The name of the file containing a surface definition.
surface_filename | char* |
Definition at line 137 of file pairExpInteractionEnergyProcessor.h.
const char* BALL::PairExpInteractionEnergyProcessor::Option::SURFACE_TYPE [static] |
The type of surface to be used.
surface_type | int the type of the surface |
Definition at line 131 of file pairExpInteractionEnergyProcessor.h.
const char* BALL::PairExpInteractionEnergyProcessor::Option::USE_RDF [static] |
RDF option. This option states whether the RDF should be considered during the integrtion or not. Use bool values with this option.
verbosity | integer |
Definition at line 109 of file pairExpInteractionEnergyProcessor.h.
const char* BALL::PairExpInteractionEnergyProcessor::Option::VERBOSITY [static] |
The verbosity level. Use integer values with this option.
verbosity | integer |
Definition at line 87 of file pairExpInteractionEnergyProcessor.h.