pyxtp::XTPTools Class Reference

#include <xtp_bind_tools.h>

Collaboration diagram for pyxtp::XTPTools:

Public Member Functions
void	Initialize (const std::string &calculatorName, Index nThreads, votca::tools::Property prop)

Private Attributes
std::unique_ptr< xtp::QMTool >	tool_

Detailed Description

Definition at line 35 of file xtp_bind_tools.h.

Member Function Documentation

Initialize()

void pyxtp::XTPTools::Initialize	(	const std::string &	calculatorName,
		Index	nThreads,
		votca::tools::Property	prop
	)

Definition at line 38 of file xtp_tools.cc.

Member Data Documentation

tool_

std::unique_ptr<xtp::QMTool> pyxtp::XTPTools::tool_

private

Definition at line 41 of file xtp_bind_tools.h.

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The documentation for this class was generated from the following files:

• xtp/src/pyxtp/binds/include/xtp_bind_tools.h
• xtp/src/pyxtp/binds/xtp_tools.cc