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