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votca 2025.1-dev
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This is the complete list of members for votca::xtp::JobTopology, including all inherited members.
| begin() | votca::xtp::JobTopology | inline |
| begin() const | votca::xtp::JobTopology | inline |
| BuildRegions(const Topology &top, std::pair< std::string, tools::Property > options) | votca::xtp::JobTopology | |
| CheckEnumerationOfRegions(const tools::Property ®ions_def) const | votca::xtp::JobTopology | private |
| CreateRegions(const std::pair< std::string, tools::Property > &options, const Topology &top, const std::vector< std::vector< SegId > > ®ion_seg_ids) | votca::xtp::JobTopology | private |
| end() | votca::xtp::JobTopology | inline |
| end() const | votca::xtp::JobTopology | inline |
| job_ | votca::xtp::JobTopology | private |
| JobTopology(Job &job, Logger &log, std::string workdir) | votca::xtp::JobTopology | inline |
| jobtopology_version() | votca::xtp::JobTopology | inlineprivatestatic |
| log_ | votca::xtp::JobTopology | private |
| ModifyOptionsByJobFile(tools::Property ®ions_def) const | votca::xtp::JobTopology | private |
| PartitionRegions(const tools::Property ®ions_def, const Topology &top) const | votca::xtp::JobTopology | private |
| ReadFromHdf5(std::string filename) | votca::xtp::JobTopology | |
| Regions() const | votca::xtp::JobTopology | inline |
| Regions() | votca::xtp::JobTopology | inline |
| regions_ | votca::xtp::JobTopology | private |
| ShiftPBC(const Topology &top, const Eigen::Vector3d ¢er, T &mol) const | votca::xtp::JobTopology | private |
| size() const | votca::xtp::JobTopology | inline |
| SortRegionsDefbyId(const tools::Property ®ions_def) const | votca::xtp::JobTopology | private |
| workdir_ | votca::xtp::JobTopology | private |
| WriteToHdf5(std::string filename) const | votca::xtp::JobTopology | |
| WriteToPdb(std::string filename) const | votca::xtp::JobTopology |