protocols::toolbox::match_enzdes_util::GeomSampleInfo Class Reference

class that stores information of one geometric parameter line of the .cst file i.e. angleA or torsionB More...

#include <MatchConstraintFileInfo.hh>

Inheritance diagram for protocols::toolbox::match_enzdes_util::GeomSampleInfo:

Collaboration diagram for protocols::toolbox::match_enzdes_util::GeomSampleInfo:

List of all members.

Public Member Functions
	GeomSampleInfo (std::string tag)
	GeomSampleInfo (core::Real ideal_val, core::Real tolerance, core::Real force_k, core::Real periodicity_)
bool	read_data (std::istringstream &line_stream)
	data reading routine
utility::vector1< core::Real >	create_sample_vector () const
	creates an explicit sample vector from the input data i.e. translates ideal value, tolerance, num_steps and periodicity into a vector of values
std::string	tag () const
core::Real	ideal_val () const
core::Real	tolerance () const
core::Real	periodicity () const
core::Real	force_const () const
core::Size	num_steps () const
core::Real	step_size () const
std::string	function_tag () const

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Detailed Description

class that stores information of one geometric parameter line of the .cst file i.e. angleA or torsionB

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Constructor & Destructor Documentation

protocols::toolbox::match_enzdes_util::GeomSampleInfo::GeomSampleInfo

(

std::string

tag

)

protocols::toolbox::match_enzdes_util::GeomSampleInfo::GeomSampleInfo	(	core::Real	ideal_val,
		core::Real	tolerance,
		core::Real	force_k,
		core::Real	periodicity_
	)

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Member Function Documentation

utility::vector1< core::Real > protocols::toolbox::match_enzdes_util::GeomSampleInfo::create_sample_vector

(

)

const

creates an explicit sample vector from the input data i.e. translates ideal value, tolerance, num_steps and periodicity into a vector of values

References core::kinematics::distance(), and protocols::toolbox::match_enzdes_util::tr().

core::Real protocols::toolbox::match_enzdes_util::GeomSampleInfo::force_const

(

)

const [inline]

std::string protocols::toolbox::match_enzdes_util::GeomSampleInfo::function_tag

(

)

const [inline]

core::Real protocols::toolbox::match_enzdes_util::GeomSampleInfo::ideal_val

(

)

const [inline]

core::Size protocols::toolbox::match_enzdes_util::GeomSampleInfo::num_steps

(

)

const [inline]

core::Real protocols::toolbox::match_enzdes_util::GeomSampleInfo::periodicity

(

)

const [inline]

bool protocols::toolbox::match_enzdes_util::GeomSampleInfo::read_data

(

std::istringstream &

line_stream

)

data reading routine

References protocols::toolbox::match_enzdes_util::tr().

core::Real protocols::toolbox::match_enzdes_util::GeomSampleInfo::step_size

(

)

const [inline]

std::string protocols::toolbox::match_enzdes_util::GeomSampleInfo::tag

(

)

const [inline]

core::Real protocols::toolbox::match_enzdes_util::GeomSampleInfo::tolerance

(

)

const [inline]

Referenced by protocols::match::downstream::AtomDihedralSecMatchRPE::AtomDihedralSecMatchRPE().

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

• src/protocols/toolbox/match_enzdes_util/MatchConstraintFileInfo.hh
• src/protocols/toolbox/match_enzdes_util/MatchConstraintFileInfo.cc