RDKit
Open-source cheminformatics and machine learning.
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MolFragmenterJSONParser.h
Go to the documentation of this file.
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//
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// Copyright (C) 2024 Novartis Biomedical Research and other RDKit contributors
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//
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// @@ All Rights Reserved @@
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// This file is part of the RDKit.
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// The contents are covered by the terms of the BSD license
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// which is included in the file license.txt, found at the root
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// of the RDKit source tree.
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//
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#pragma once
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#include "
MolFragmenter.h
"
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namespace
RDKit
{
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//! \brief Parse MolzipParams from JSON.
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/*! The passed MolzipParams instance is updated from
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* the JSON-parsed content.
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*
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* @param params - molzip parameters
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* @param details_json - JSON string
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*/
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RDKIT_CHEMTRANSFORMS_EXPORT
void
parseMolzipParametersJSON
(
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MolzipParams
¶ms,
const
char
*
details_json
);
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}
// end namespace RDKit
MolFragmenter.h
RDKIT_CHEMTRANSFORMS_EXPORT
#define RDKIT_CHEMTRANSFORMS_EXPORT
Definition
export.h:57
RDKit
Std stuff.
Definition
Abbreviations.h:19
RDKit::rdvalue_is
bool rdvalue_is(const RDValue_cast_t)
Definition
RDValue-doublemagic.h:372
RDKit::parseMolzipParametersJSON
RDKIT_CHEMTRANSFORMS_EXPORT void parseMolzipParametersJSON(MolzipParams ¶ms, const char *details_json)
Parse MolzipParams from JSON.
RDKit::MolzipParams
Definition
MolFragmenter.h:117
GraphMol
ChemTransforms
MolFragmenterJSONParser.h
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