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PLMD
RMSDCoreData
PLMD::RMSDCoreData Member List
This is the complete list of members for
PLMD::RMSDCoreData
, including all inherited members.
alEqDis
PLMD::RMSDCoreData
private
align
PLMD::RMSDCoreData
private
calcPositionsCenter
()
PLMD::RMSDCoreData
inline
calcReferenceCenter
()
PLMD::RMSDCoreData
inline
cpositions
PLMD::RMSDCoreData
private
cpositions_is_calculated
PLMD::RMSDCoreData
private
cpositions_is_removed
PLMD::RMSDCoreData
private
creference
PLMD::RMSDCoreData
private
creference_is_calculated
PLMD::RMSDCoreData
private
creference_is_removed
PLMD::RMSDCoreData
private
d
PLMD::RMSDCoreData
private
ddist_drotation
PLMD::RMSDCoreData
private
ddist_drr01
PLMD::RMSDCoreData
private
displace
PLMD::RMSDCoreData
private
dist
PLMD::RMSDCoreData
private
distanceIsMSD
PLMD::RMSDCoreData
private
doCoreCalc
(bool safe, bool alEqDis, bool only_rotation=false)
PLMD::RMSDCoreData
doCoreCalcWithCloseStructure
(bool safe, bool alEqDis, const Tensor &rotationPosClose, const Tensor &rotationRefClose, std::array< std::array< Tensor, 3 >, 3 > &drotationPosCloseDrr01)
PLMD::RMSDCoreData
drotation_drr01
PLMD::RMSDCoreData
private
eigenvals
PLMD::RMSDCoreData
private
eigenvecs
PLMD::RMSDCoreData
private
getAlignedPositionsToReference
()
PLMD::RMSDCoreData
getAlignedReferenceToPositions
()
PLMD::RMSDCoreData
getCenteredPositions
()
PLMD::RMSDCoreData
getCenteredReference
()
PLMD::RMSDCoreData
getDDistanceDPositions
()
PLMD::RMSDCoreData
getDDistanceDReference
()
PLMD::RMSDCoreData
getDDistanceDReferenceSOMA
()
PLMD::RMSDCoreData
getDistance
(bool squared)
PLMD::RMSDCoreData
getDRotationDPositions
(bool inverseTransform=false)
PLMD::RMSDCoreData
getDRotationDReference
(bool inverseTransform=false)
PLMD::RMSDCoreData
getDRotationDRr01
() const
PLMD::RMSDCoreData
getPositionsCenter
()
PLMD::RMSDCoreData
getPositionsCenterIsRemoved
()
PLMD::RMSDCoreData
inline
getReferenceCenter
()
PLMD::RMSDCoreData
getReferenceCenterIsRemoved
()
PLMD::RMSDCoreData
inline
getRotationMatrixPositionsToReference
()
PLMD::RMSDCoreData
getRotationMatrixReferenceToPositions
()
PLMD::RMSDCoreData
hasDistance
PLMD::RMSDCoreData
private
isInitialized
PLMD::RMSDCoreData
private
positions
PLMD::RMSDCoreData
private
reference
PLMD::RMSDCoreData
private
retrieve_only_rotation
PLMD::RMSDCoreData
private
RMSDCoreData
(const std::vector< double > &a, const std::vector< double > &d, const std::vector< Vector > &p, const std::vector< Vector > &r, Vector &cp, Vector &cr)
PLMD::RMSDCoreData
inline
RMSDCoreData
(const std::vector< double > &a, const std::vector< double > &d, const std::vector< Vector > &p, const std::vector< Vector > &r)
PLMD::RMSDCoreData
inline
rotation
PLMD::RMSDCoreData
private
rr00
PLMD::RMSDCoreData
private
rr11
PLMD::RMSDCoreData
private
safe
PLMD::RMSDCoreData
private
setPositionsCenter
(Vector v)
PLMD::RMSDCoreData
inline
setPositionsCenterIsRemoved
(bool t)
PLMD::RMSDCoreData
inline
setReferenceCenter
(Vector v)
PLMD::RMSDCoreData
inline
setReferenceCenterIsRemoved
(bool t)
PLMD::RMSDCoreData
inline
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1.17.0