Abstract base class that holds molecule independent arguments that are common amongst all fingerprint types and classes inherited from this would hold fingerprint type specific arguments.
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#include <FingerprintGenerator.h>
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| FingerprintArguments (bool countSimulation, const std::vector< std::uint32_t > countBounds, std::uint32_t fpSize, std::uint32_t numBitsPerFeature=1, bool includeChirality=false) |
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virtual std::string | infoString () const =0 |
| method that returns information string about the fingerprint specific argument set and the arguments themselves
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std::string | commonArgumentsString () const |
| method that returns information string about common fingerprinting arguments' values
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virtual | ~FingerprintArguments () |
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| FingerprintArguments ()=default |
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Abstract base class that holds molecule independent arguments that are common amongst all fingerprint types and classes inherited from this would hold fingerprint type specific arguments.
Definition at line 79 of file FingerprintGenerator.h.
◆ FingerprintArguments() [1/2]
RDKit::FingerprintArguments::FingerprintArguments |
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bool | countSimulation, |
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const std::vector< std::uint32_t > | countBounds, |
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std::uint32_t | fpSize, |
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std::uint32_t | numBitsPerFeature = 1, |
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bool | includeChirality = false ) |
◆ ~FingerprintArguments()
virtual RDKit::FingerprintArguments::~FingerprintArguments |
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inlinevirtual |
◆ FingerprintArguments() [2/2]
RDKit::FingerprintArguments::FingerprintArguments |
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default |
◆ commonArgumentsString()
std::string RDKit::FingerprintArguments::commonArgumentsString |
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const |
method that returns information string about common fingerprinting arguments' values
- Returns
- std::string information string
◆ infoString()
virtual std::string RDKit::FingerprintArguments::infoString |
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const |
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pure virtual |
◆ d_countBounds
std::vector<std::uint32_t> RDKit::FingerprintArguments::d_countBounds |
◆ d_fpSize
std::uint32_t RDKit::FingerprintArguments::d_fpSize = 2048 |
◆ d_numBitsPerFeature
std::uint32_t RDKit::FingerprintArguments::d_numBitsPerFeature = 1 |
◆ df_countSimulation
bool RDKit::FingerprintArguments::df_countSimulation = false |
◆ df_includeChirality
bool RDKit::FingerprintArguments::df_includeChirality = false |
The documentation for this class was generated from the following file: