CrystCluster Class Reference

Inheritance diagram for CrystCluster:

Public Member Functions
	CrystCluster ()=default
Pose	transform_pdb (Pose const &pose, SpacegroupHit sh)
void	apply (Pose &pose) override
std::string	get_name () const override

Constructor & Destructor Documentation

CrystCluster()

CrystCluster::CrystCluster ( )

default

Member Function Documentation

apply()

void CrystCluster::apply ( Pose &  pose )

inlineoverride

References basic::options::OptionKeys::corrections::water::cluster_cutoff, utility::options::OptionKeys::options::exit, getline(), create_a3b_hbs::i, basic::options::OptionKeys::in::in, create_a3b_hbs::j, line, option, lactamize::outfile, outs, beta_nonlocal::pose, test.T008_Serialization::pose1, test.T008_Serialization::pose2, loops_kic::rms, and basic::TR.

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

get_name()

std::string CrystCluster::get_name ( ) const

inlineoverride

transform_pdb()

Pose CrystCluster::transform_pdb ( Pose const &  pose, SpacegroupHit  sh  )

inline

References add_crystinfo_to_pose(), beta_nonlocal::pose, SpacegroupHit::R, SpacegroupHit::sg, and SpacegroupHit::T.

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

• src/apps/pilot/frank/cryst_design.cc