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votca 2025.1-dev
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This is the complete list of members for votca::xtp::QMCalculator, including all inherited members.
| Calculator()=default | votca::tools::Calculator | |
| Evaluate(Topology &top)=0 | votca::xtp::QMCalculator | protectedpure virtual |
| EvaluateFrame(Topology &top) | votca::xtp::QMCalculator | |
| Identify() const override=0 | votca::xtp::QMCalculator | pure virtual |
| Initialize(const tools::Property &opt) final | votca::xtp::QMCalculator | virtual |
| maverick_ | votca::tools::Calculator | protected |
| nThreads_ | votca::tools::Calculator | protected |
| Package() const final | votca::xtp::QMCalculator | inlinevirtual |
| ParseOptions(const tools::Property &opt)=0 | votca::xtp::QMCalculator | protectedpure virtual |
| QMCalculator()=default | votca::xtp::QMCalculator | |
| setnThreads(Index nThreads) | votca::tools::Calculator | inline |
| WriteToStateFile() const =0 | votca::xtp::QMCalculator | pure virtual |
| ~Calculator()=default | votca::tools::Calculator | virtual |
| ~QMCalculator() override=default | votca::xtp::QMCalculator |