CovalentPeptidomimeticCreator Class Reference

Inheritance diagram for CovalentPeptidomimeticCreator:

Public Member Functions
	CovalentPeptidomimeticCreator ()
	~CovalentPeptidomimeticCreator () override=default
void	apply (core::pose::Pose &pose) override
void	update_hydrogens (core::pose::Pose &pose)
std::string	get_name () const override

Constructor & Destructor Documentation

CovalentPeptidomimeticCreator()

CovalentPeptidomimeticCreator::CovalentPeptidomimeticCreator ( )

inline

~CovalentPeptidomimeticCreator()

CovalentPeptidomimeticCreator::~CovalentPeptidomimeticCreator ( )

overridedefault

Member Function Documentation

apply()

void CovalentPeptidomimeticCreator::apply ( core::pose::Pose &  pose )

override

References basic::options::OptionKeys::chemical::chemical, utility::io::oc::cout, CZ, func, vancomycin::harm, create_a3b_hbs::i, internal_coordinates::indices, vancomycin::min_mover, basic::options::OptionKeys::MonteCarlo::MonteCarlo, option, test.C001_Carbohydrates_Demo01::peptide, cov_creator::peptide_pdb, cov_creator::peptide_res, orn_macrocycle::pert_mc, vancomycin::pert_mm, beta_nonlocal::pose, pyrosetta.distributed.io::pose_from_file, basic::options::OptionKeys::stepwise::protein::protein, cov_creator::protein_pdb, cov_creator::protein_res, lactamize::residue_set_cap, runtime_assert, oop_conformations::scorefxn, basic::options::OptionKeys::frags::scoring::scoring, vancomycin::task, basic::options::OptionKeys::inout::dbms::user, and value.

Referenced by pyrosetta.distributed.tasks.rosetta_scripts.BaseRosettaScriptsTask::execute().

get_name()

std::string CovalentPeptidomimeticCreator::get_name ( ) const

inlineoverride

update_hydrogens()

void CovalentPeptidomimeticCreator::update_hydrogens

(

core::pose::Pose &

pose

)

References basic::options::OptionKeys::chemical::chemical, utility::io::oc::cout, numeric::conversions::degrees(), numeric::dihedral_degrees(), create_a3b_hbs::ii, beta_nonlocal::jj, beta_nonlocal::pose, and numeric::conversions::radians().

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

• src/apps/pilot/awatkins/cov_peptidomimetic_creator.cc