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votca 2024-dev
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This is the complete list of members for votca::xtp::Orb2Mol, including all inherited members.
| aux_basisset_name_ | votca::xtp::Orb2Mol | private |
| basisset_name_ | votca::xtp::Orb2Mol | private |
| Calculator()=default | votca::tools::Calculator | |
| Evaluate() | votca::xtp::QMTool | |
| Identify() const | votca::xtp::Orb2Mol | inlinevirtual |
| Initialize(const tools::Property &options) final | votca::xtp::QMTool | virtual |
| job_name_ | votca::xtp::QMTool | protected |
| log_ | votca::xtp::Orb2Mol | private |
| maverick_ | votca::tools::Calculator | protected |
| moldenfile_ | votca::xtp::Orb2Mol | private |
| nThreads_ | votca::tools::Calculator | protected |
| Orb2Mol()=default | votca::xtp::Orb2Mol | |
| orbfile_ | votca::xtp::Orb2Mol | private |
| Package() const final | votca::xtp::QMTool | inlinevirtual |
| ParseOptions(const tools::Property &user_options) | votca::xtp::Orb2Mol | protectedvirtual |
| QMTool()=default | votca::xtp::QMTool | |
| Run() | votca::xtp::Orb2Mol | protectedvirtual |
| setnThreads(Index nThreads) | votca::tools::Calculator | inline |
| xyzfile_ | votca::xtp::Orb2Mol | private |
| ~Calculator()=default | votca::tools::Calculator | virtual |
| ~Orb2Mol()=default | votca::xtp::Orb2Mol | |
| ~QMTool() override=default | votca::xtp::QMTool |
1.9.7