RDKit
Open-source cheminformatics and machine learning.
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#include <RGroupGa.h>
Public Member Functions | |
GaResult (const double score, const vector< vector< size_t > > &permutations) | |
GaResult (const GaResult &other) | |
GaResult () | |
GaResult & | operator= (const GaResult &other) |
Public Attributes | |
RGroupScorer | rGroupScorer |
Definition at line 90 of file RGroupGa.h.
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inline |
Definition at line 93 of file RGroupGa.h.
Definition at line 95 of file RGroupGa.h.
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inline |
Definition at line 97 of file RGroupGa.h.
RGroupScorer RDKit::GaResult::rGroupScorer |
Definition at line 91 of file RGroupGa.h.