BALL
1.4.1
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#include <BALL/MOLMEC/MMFF94/MMFF94.h>
Static Public Attributes | |
static const char * | FOLDER |
static const char * | ASSIGN_CHARGES |
static const char * | ASSIGN_TYPENAMES |
static const char * | ASSIGN_TYPES |
static const char * | OVERWRITE_CHARGES |
static const char * | OVERWRITE_TYPENAMES |
static const char * | NONBONDED_CUTOFF |
static const char * | VDW_CUTOFF |
static const char * | VDW_CUTON |
static const char * | ELECTROSTATIC_CUTOFF |
static const char * | ELECTROSTATIC_CUTON |
static const char * | DISTANCE_DEPENDENT_DIELECTRIC |
const char* BALL::MMFF94::Option::ASSIGN_CHARGES [static] |
const char* BALL::MMFF94::Option::ASSIGN_TYPENAMES [static] |
const char* BALL::MMFF94::Option::ASSIGN_TYPES [static] |
const char* BALL::MMFF94::Option::DISTANCE_DEPENDENT_DIELECTRIC [static] |
const char* BALL::MMFF94::Option::ELECTROSTATIC_CUTOFF [static] |
const char* BALL::MMFF94::Option::ELECTROSTATIC_CUTON [static] |
const char* BALL::MMFF94::Option::FOLDER [static] |
const char* BALL::MMFF94::Option::NONBONDED_CUTOFF [static] |
Nonbonded cutoff. This value is used as cutoff radius in calculations of nonbonded interactions. The unit of this option is (
const char* BALL::MMFF94::Option::OVERWRITE_CHARGES [static] |
const char* BALL::MMFF94::Option::OVERWRITE_TYPENAMES [static] |
const char* BALL::MMFF94::Option::VDW_CUTOFF [static] |
const char* BALL::MMFF94::Option::VDW_CUTON [static] |