Collaboration diagram for votca::xtp::SegmentMapper< AtomContainer >::Seginfo:
Public Attributes | |
| std::pair< Index, Index > | minmax |
| std::vector< Index > | mdatoms |
| std::vector< FragInfo > | fragments |
| bool | map2md |
| std::string | segname |
| std::vector< double > | weights |
| std::vector< atom_id > | mapatoms |
| std::map< std::string, std::string > | coordfiles |
Detailed Description
template<class AtomContainer>
struct votca::xtp::SegmentMapper< AtomContainer >::Seginfo
struct votca::xtp::SegmentMapper< AtomContainer >::Seginfo
Definition at line 63 of file segmentmapper.h.
Member Data Documentation
◆ coordfiles
template<class AtomContainer >
| std::map<std::string, std::string> votca::xtp::SegmentMapper< AtomContainer >::Seginfo::coordfiles |
Definition at line 71 of file segmentmapper.h.
◆ fragments
template<class AtomContainer >
| std::vector<FragInfo> votca::xtp::SegmentMapper< AtomContainer >::Seginfo::fragments |
Definition at line 66 of file segmentmapper.h.
◆ map2md
template<class AtomContainer >
| bool votca::xtp::SegmentMapper< AtomContainer >::Seginfo::map2md |
Definition at line 67 of file segmentmapper.h.
◆ mapatoms
template<class AtomContainer >
| std::vector<atom_id> votca::xtp::SegmentMapper< AtomContainer >::Seginfo::mapatoms |
Definition at line 70 of file segmentmapper.h.
◆ mdatoms
template<class AtomContainer >
| std::vector<Index> votca::xtp::SegmentMapper< AtomContainer >::Seginfo::mdatoms |
Definition at line 65 of file segmentmapper.h.
◆ minmax
template<class AtomContainer >
| std::pair<Index, Index> votca::xtp::SegmentMapper< AtomContainer >::Seginfo::minmax |
Definition at line 64 of file segmentmapper.h.
◆ segname
template<class AtomContainer >
| std::string votca::xtp::SegmentMapper< AtomContainer >::Seginfo::segname |
Definition at line 68 of file segmentmapper.h.
◆ weights
template<class AtomContainer >
| std::vector<double> votca::xtp::SegmentMapper< AtomContainer >::Seginfo::weights |
Definition at line 69 of file segmentmapper.h.
The documentation for this struct was generated from the following file:
- xtp/include/votca/xtp/segmentmapper.h
