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clang-tidy modernize-use-default-member-init and modernize-use-emplace (#3190)

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* run clang-tidy with modernize-use-default-member-init

* results from modernize-use-emplace

* one uniform initialization per line
otherwise SWIG is unhappy

Co-authored-by: Brian Kelley <fustigator@gmail.com>
This commit is contained in:
Greg Landrum
2020-05-28 09:07:58 +02:00
committed by GitHub
parent c346aa1492
commit 45b9aef28b
134 changed files with 620 additions and 739 deletions
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17
Code/DistGeom/ChiralViolationContrib.h
View File

@@ -17,13 +17,8 @@ class RDKIT_DISTGEOMETRY_EXPORT ChiralViolationContrib
: public ForceFields::ForceFieldContrib {
public:
ChiralViolationContrib()
: d_idx1(0),
d_idx2(0),
d_idx3(0),
d_idx4(0),
d_volLower(0.0),
d_volUpper(0.0),
d_weight(0.0){};
{};
//! Constructor
/*!
@@ -93,10 +88,10 @@ class RDKIT_DISTGEOMETRY_EXPORT ChiralViolationContrib
}
private:
unsigned int d_idx1, d_idx2, d_idx3, d_idx4;
double d_volLower;
double d_volUpper;
double d_weight;
unsigned int d_idx1{0}, d_idx2{0}, d_idx3{0}, d_idx4{0};
double d_volLower{0.0};
double d_volUpper{0.0};
double d_weight{0.0};
};
} // namespace DistGeom

10
Code/DistGeom/DistViolationContrib.h
View File

@@ -20,7 +20,7 @@ class RDKIT_DISTGEOMETRY_EXPORT DistViolationContrib
: public ForceFields::ForceFieldContrib {
public:
DistViolationContrib()
: d_end1Idx(0), d_end2Idx(0), d_ub(1000.0), d_lb(0.0), d_weight(1.0){};
{};
//! Constructor
/*!
@@ -43,10 +43,10 @@ class RDKIT_DISTGEOMETRY_EXPORT DistViolationContrib
};
private:
unsigned int d_end1Idx, d_end2Idx; //!< indices of end points
double d_ub; //!< upper bound on the distance between d_end1Idx,d_end2Idx
double d_lb; //!< lower bound on the distance between d_end1Idx,d_end2Idx
double d_weight; //!< used to adjust relative contribution weights
unsigned int d_end1Idx{0}, d_end2Idx{0}; //!< indices of end points
double d_ub{1000.0}; //!< upper bound on the distance between d_end1Idx,d_end2Idx
double d_lb{0.0}; //!< lower bound on the distance between d_end1Idx,d_end2Idx
double d_weight{1.0}; //!< used to adjust relative contribution weights
};
} // namespace DistGeom

6
Code/DistGeom/FourthDimContrib.h
View File

@@ -15,7 +15,7 @@ namespace DistGeom {
class RDKIT_DISTGEOMETRY_EXPORT FourthDimContrib
: public ForceFields::ForceFieldContrib {
public:
FourthDimContrib() : d_idx(0), d_weight(0.0){};
FourthDimContrib() {};
//! Constructor
/*!
@@ -57,8 +57,8 @@ class RDKIT_DISTGEOMETRY_EXPORT FourthDimContrib
};
private:
unsigned int d_idx;
double d_weight;
unsigned int d_idx{0};
double d_weight{0.0};
};
} // namespace DistGeom