triazolamer_creator.cc File Reference

#include <iostream>
#include <string>
#include <devel/init.hh>
#include <core/types.hh>
#include <core/conformation/Conformation.hh>
#include <core/conformation/Residue.hh>
#include <core/pose/Pose.hh>
#include <core/pose/ncbb/util.hh>
#include <core/scoring/ScoreFunctionFactory.hh>
#include <core/scoring/ScoreFunction.hh>
#include <core/chemical/ChemicalManager.hh>
#include <core/chemical/ResidueTypeSet.hh>
#include <core/kinematics/MoveMap.hh>
#include <core/pack/task/TaskFactory.hh>
#include <core/pack/task/operation/TaskOperations.hh>
#include <core/scoring/func/SumFunc.hh>
#include <protocols/jd2/JobDistributor.hh>
#include <protocols/minimization_packing/MinMover.hh>
#include <protocols/simple_moves/BackboneMover.fwd.hh>
#include <protocols/ncbb/a3b_hbs/A3BHbsPatcher.hh>
#include <utility/excn/Exceptions.hh>
#include <numeric/random/random.hh>
#include <basic/options/keys/OptionKeys.hh>

Classes
class	TriazoleCreator

Typedefs
using	TriazoleCreatorOP = utility::pointer::shared_ptr< TriazoleCreator >
using	TriazoleCreatorCOP = utility::pointer::shared_ptr< const TriazoleCreator >

Functions
void	perturb_and_rescore (core::pose::Pose &pose, core::scoring::ScoreFunctionOP sfxn)
int	main (int argc, char *argv[])

Typedef Documentation

TriazoleCreatorCOP

using TriazoleCreatorCOP = utility::pointer::shared_ptr<const TriazoleCreator>

TriazoleCreatorOP

using TriazoleCreatorOP = utility::pointer::shared_ptr<TriazoleCreator>

Function Documentation

main()

int main	(	int	argc,
		char *	argv[]
	)

References argv, test.T009_Exceptions::e, and basic::init().

perturb_and_rescore()

void perturb_and_rescore	(	core::pose::Pose &	pose,
		core::scoring::ScoreFunctionOP	sfxn
	)

References utility::io::oc::cout, numeric::random::RandomGenerator::gaussian(), create_a3b_hbs::i, create_a3b_hbs::j, test.Workshop4test::new_score, beta_nonlocal::pose, numeric::random::rg(), test.T120_core::sfxn, and numeric::random::RandomGenerator::uniform().