#include <GasteigerParams.h>
Definition at line 30 of file GasteigerParams.h.
◆ ~GasteigerParams()
RDKit::GasteigerParams::~GasteigerParams |
( |
| ) |
|
|
inline |
◆ GasteigerParams()
RDKit::GasteigerParams::GasteigerParams |
( |
std::string | paramData = "" | ) |
|
◆ getParams() [1/2]
static const GasteigerParams * RDKit::GasteigerParams::getParams |
( |
const std::string & | paramData = "" | ) |
|
|
static |
◆ getParams() [2/2]
DOUBLE_VECT RDKit::GasteigerParams::getParams |
( |
std::string | elem, |
|
|
std::string | mode, |
|
|
bool | throwOnFailure = false ) const |
|
inline |
The documentation for this class was generated from the following file: