#include "votca/tools/property.h"#include "votca/xtp/qmtool.h"#include "votca/xtp/toolfactory.h"#include <string>
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Classes | |
| class | pyxtp::XTPTools |
Namespaces | |
| namespace | pyxtp |
Functions | |
| void | pyxtp::call_tool (const std::string &calculatorName, Index nThreads, std::string xmlfile) |
| Construct a new pybind11 module object to invoke a votca-xtp QMTool. | |
