| addRemark(const std::vector< std::string > &v1) | PLMD::PDB | |
| atomsymb | PLMD::PDB | private |
| beta | PLMD::PDB | private |
| block_ends | PLMD::PDB | private |
| chain | PLMD::PDB | private |
| checkForAtom(const std::string &name) const | PLMD::PDB | |
| checkForResidue(const std::string &name) const | PLMD::PDB | |
| getAtomBlockEnds() const | PLMD::PDB | |
| getAtomName(AtomNumber a) const | PLMD::PDB | |
| getAtomNumbers() const | PLMD::PDB | |
| getAtomRange(const std::string &chainname, AtomNumber &a_start, AtomNumber &a_end, std::string &errmsg) const | PLMD::PDB | |
| getAtomsInChain(const std::string &chainid) const | PLMD::PDB | |
| getAtomsInResidue(const unsigned &resnum, const std::string &chainid) const | PLMD::PDB | |
| getBeta() const | PLMD::PDB | |
| getChainID(const unsigned &resnumber) const | PLMD::PDB | |
| getChainNames(std::vector< std::string > &chains) const | PLMD::PDB | |
| getNamedAtomFromResidue(const std::string &aname, const unsigned &resnum) const | PLMD::PDB | |
| getNamedAtomFromResidueAndChain(const std::string &aname, const unsigned &resnum, const std::string &chain) const | PLMD::PDB | |
| getNumberOfAtomBlocks() const | PLMD::PDB | |
| getOccupancy() const | PLMD::PDB | |
| getPosition(AtomNumber a) const | PLMD::PDB | |
| getPositions() const | PLMD::PDB | |
| getRemark() const | PLMD::PDB | |
| getResidueName(AtomNumber a) const | PLMD::PDB | |
| getResidueName(const unsigned &resnum) const | PLMD::PDB | |
| getResidueName(const unsigned &resnum, const std::string &chain) const | PLMD::PDB | |
| getResidueNumber(AtomNumber a) const | PLMD::PDB | |
| getResidueRange(const std::string &chainname, unsigned &res_start, unsigned &res_end, std::string &errmsg) const | PLMD::PDB | |
| number2index | PLMD::PDB | private |
| numbers | PLMD::PDB | private |
| occupancy | PLMD::PDB | private |
| operator<<(Log &ostr, const PDB &pdb) | PLMD::PDB | friend |
| positions | PLMD::PDB | private |
| read(const std::string &file, bool naturalUnits, double scale) | PLMD::PDB | |
| readFromFilepointer(FILE *fp, bool naturalUnits, double scale) | PLMD::PDB | |
| remark | PLMD::PDB | private |
| residue | PLMD::PDB | private |
| residuenames | PLMD::PDB | private |
| setArgKeyword(const std::string &new_args) | PLMD::PDB | |
| setPositions(const std::vector< Vector > &v) | PLMD::PDB | |
| size() const | PLMD::PDB | |