Scine::Swoose  2.1.0
This is the SCINE module Swoose.
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BasicJobSubmissionHelper.cpp File Reference
#include "BasicJobSubmissionHelper.h"
#include "OptionNames.h"
#include "SettingsNames.h"
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Functions

std::string Scine::SwooseUtilities::BasicJobSubmissionHelper::determineMethodFamily (std::string method, std::string referenceProgram)
 Determines the method family for the employed methods/programs.
 
std::string Scine::SwooseUtilities::BasicJobSubmissionHelper::determineBasisSet (const Utils::Settings &settings)
 Determines whether the basis set for the employed methods/programs should be empty. If not, it returns the basis set from the settings (given as an argument).
 

Detailed Description