votca::xtp::Topology Member List

This is the complete list of members for votca::xtp::Topology, including all inherited members.

AddSegment(std::string segment_name)	votca::xtp::Topology
AutoDetectBoxType(const Eigen::Matrix3d &box)	votca::xtp::Topology	private
bc_	votca::xtp::Topology	private
BoxVolume() const	votca::xtp::Topology	inline
FindAllSegmentsOnMolecule(const Segment &seg1, const Segment &seg2) const	votca::xtp::Topology
getBox() const	votca::xtp::Topology	inline
getSegment(Index id)	votca::xtp::Topology	inline
getSegment(Index id) const	votca::xtp::Topology	inline
GetShortestDist(const Segment &seg1, const Segment &seg2) const	votca::xtp::Topology
getStep() const	votca::xtp::Topology	inline
getTime() const	votca::xtp::Topology	inline
NBList()	votca::xtp::Topology	inline
NBList() const	votca::xtp::Topology	inline
nblist_	votca::xtp::Topology	private
operator=(const Topology &top)	votca::xtp::Topology
PbShortestConnect(const Eigen::Vector3d &r1, const Eigen::Vector3d &r2) const	votca::xtp::Topology
ReadFromCpt(CheckpointReader &r)	votca::xtp::Topology
Segments()	votca::xtp::Topology	inline
Segments() const	votca::xtp::Topology	inline
segments_	votca::xtp::Topology	private
setBox(const Eigen::Matrix3d &box, csg::BoundaryCondition::eBoxtype boxtype=csg::BoundaryCondition::typeAuto)	votca::xtp::Topology
setStep(Index step)	votca::xtp::Topology	inline
setTime(double time)	votca::xtp::Topology	inline
step_	votca::xtp::Topology	private
time_	votca::xtp::Topology	private
Topology()=default	votca::xtp::Topology
Topology(const Topology &top)	votca::xtp::Topology
topology_version()	votca::xtp::Topology	inlineprivatestatic
WriteToCpt(CheckpointWriter &w) const	votca::xtp::Topology
WriteToPdb(std::string filename) const	votca::xtp::Topology