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- fixed a few missing "const" declarations on "get" functions

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This commit is contained in:
Paolo Tosco
2016-02-21 21:24:56 +00:00
parent d6b22d7f50
commit dbaff21056
2 changed files with 11 additions and 11 deletions
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12
Code/GraphMol/MolTransforms/MolTransforms.cpp
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@@ -244,9 +244,9 @@ void _toBeMovedIdxList(const ROMol &mol, unsigned int iAtomId,
}
}
}
double getBondLength(Conformer &conf, unsigned int iAtomId,
double getBondLength(const Conformer &conf, unsigned int iAtomId,
unsigned int jAtomId) {
RDGeom::POINT3D_VECT &pos = conf.getPositions();
const RDGeom::POINT3D_VECT &pos = conf.getPositions();
URANGE_CHECK(iAtomId, pos.size() - 1);
URANGE_CHECK(jAtomId, pos.size() - 1);
@@ -278,9 +278,9 @@ void setBondLength(Conformer &conf, unsigned int iAtomId, unsigned int jAtomId,
}
}
double getAngleRad(Conformer &conf, unsigned int iAtomId, unsigned int jAtomId,
double getAngleRad(const Conformer &conf, unsigned int iAtomId, unsigned int jAtomId,
unsigned int kAtomId) {
RDGeom::POINT3D_VECT &pos = conf.getPositions();
const RDGeom::POINT3D_VECT &pos = conf.getPositions();
URANGE_CHECK(iAtomId, pos.size() - 1);
URANGE_CHECK(jAtomId, pos.size() - 1);
URANGE_CHECK(kAtomId, pos.size() - 1);
@@ -342,10 +342,10 @@ void setAngleRad(Conformer &conf, unsigned int iAtomId, unsigned int jAtomId,
}
}
double getDihedralRad(Conformer &conf, unsigned int iAtomId,
double getDihedralRad(const Conformer &conf, unsigned int iAtomId,
unsigned int jAtomId, unsigned int kAtomId,
unsigned int lAtomId) {
RDGeom::POINT3D_VECT &pos = conf.getPositions();
const RDGeom::POINT3D_VECT &pos = conf.getPositions();
URANGE_CHECK(iAtomId, pos.size() - 1);
URANGE_CHECK(jAtomId, pos.size() - 1);
URANGE_CHECK(kAtomId, pos.size() - 1);