mirror of
https://github.com/rdkit/rdkit.git
synced 2026-06-04 21:54:27 +08:00
5f85129f22
this is minor build-system variations and some code cleanup the python wrapper still needs cleanup and the sln stuff doesn't work at all under clang due to weirdness with boost::regex
65 lines
1.9 KiB
C++
65 lines
1.9 KiB
C++
//
|
|
// Copyright (c) 2003-2006 Greg Landrum and Rational Discovery LLC
|
|
//
|
|
// @@ All Rights Reserved @@
|
|
// This file is part of the RDKit.
|
|
// The contents are covered by the terms of the BSD license
|
|
// which is included in the file license.txt, found at the root
|
|
// of the RDKit source tree.
|
|
//
|
|
#ifndef __RD_LESSEQUALQUERY_H__
|
|
#define __RD_LESSEQUALQUERY_H__
|
|
#include "Query.h"
|
|
#include "EqualityQuery.h"
|
|
|
|
namespace Queries {
|
|
//! \brief a Query implementing <= using a particular
|
|
//! value (and an optional tolerance)
|
|
template <class MatchFuncArgType, class DataFuncArgType=MatchFuncArgType,
|
|
bool needsConversion=false>
|
|
class LessEqualQuery :
|
|
public EqualityQuery<MatchFuncArgType, DataFuncArgType,needsConversion> {
|
|
|
|
public:
|
|
LessEqualQuery() {this->d_tol = 0;};
|
|
//! constructs with our target value
|
|
explicit LessEqualQuery(DataFuncArgType what) {
|
|
this->d_val = what;
|
|
this->d_tol = 0;
|
|
this->df_negate = false;
|
|
};
|
|
//! constructs with our target value and a tolerance
|
|
LessEqualQuery(DataFuncArgType v,DataFuncArgType t) {
|
|
this->d_val = v;
|
|
this->d_tol = t;
|
|
this->df_negate = false;
|
|
};
|
|
|
|
|
|
bool Match(const DataFuncArgType what) const {
|
|
MatchFuncArgType mfArg = this->TypeConvert(what,Int2Type<needsConversion>());
|
|
if( queryCmp(this->d_val,mfArg,this->d_tol) <= 0 ){
|
|
if( this->getNegation() ) return false;
|
|
else return true;
|
|
} else {
|
|
if( this->getNegation() ) return true;
|
|
else return false;
|
|
}
|
|
};
|
|
|
|
Query<MatchFuncArgType,DataFuncArgType,needsConversion> *
|
|
copy( ) const {
|
|
LessEqualQuery<MatchFuncArgType,DataFuncArgType,needsConversion> *res =
|
|
new LessEqualQuery<MatchFuncArgType,DataFuncArgType,needsConversion>();
|
|
res->setNegation(this->getNegation());
|
|
res->setVal(this->d_val);
|
|
res->setTol(this->d_tol);
|
|
res->setDataFunc(this->d_dataFunc);
|
|
res->d_description = this->d_description;
|
|
return res;
|
|
};
|
|
};
|
|
|
|
}
|
|
#endif
|