Rosetta 3.4
Public Types | Public Member Functions | Static Public Member Functions
protocols::enzdes::ProteinLigandInterfaceUpweighter Class Reference

Class to alter a packer task to speficially upweight the protein-ligand interaction energies. More...

#include <EnzdesTaskOperations.hh>

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List of all members.

Public Types

typedef
core::pack::task::operation::TaskOperationOP 
TaskOperationOP
typedef core::pose::Pose Pose
typedef
core::pack::task::PackerTask 
PackerTask

Public Member Functions

 ProteinLigandInterfaceUpweighter ()
 ~ProteinLigandInterfaceUpweighter ()
virtual TaskOperationOP clone () const
 Create another task operation of the type matching the most-derived version of the class.
void init_from_options ()
 Initialize the class based on the command line options.
virtual void apply (Pose const &pose, PackerTask &task) const
 Change a packer task in some way. The input pose is the one to which the input task will be later applied.
virtual void parse_tag (TagPtr)
 Used to parse an xml-like tag to load parameters and properties.
bool get_weight () const
void set_weight (bool const weight_in)

Static Public Member Functions

static void register_options ()

Detailed Description

Class to alter a packer task to speficially upweight the protein-ligand interaction energies.


Member Typedef Documentation


Constructor & Destructor Documentation

protocols::enzdes::ProteinLigandInterfaceUpweighter::ProteinLigandInterfaceUpweighter ( )
protocols::enzdes::ProteinLigandInterfaceUpweighter::~ProteinLigandInterfaceUpweighter ( )

Member Function Documentation

void protocols::enzdes::ProteinLigandInterfaceUpweighter::apply ( Pose const &  pose,
PackerTask task 
) const [virtual]

Change a packer task in some way. The input pose is the one to which the input task will be later applied.

Implements core::pack::task::operation::TaskOperation.

References core::pack::task::PackerTask::set_IGEdgeReweights(), and protocols::enzdes::tr().

core::pack::task::operation::TaskOperationOP protocols::enzdes::ProteinLigandInterfaceUpweighter::clone ( ) const [virtual]

Create another task operation of the type matching the most-derived version of the class.

Implements core::pack::task::operation::TaskOperation.

bool protocols::enzdes::ProteinLigandInterfaceUpweighter::get_weight ( ) const [inline]
void protocols::enzdes::ProteinLigandInterfaceUpweighter::init_from_options ( )

Initialize the class based on the command line options.

void protocols::enzdes::ProteinLigandInterfaceUpweighter::parse_tag ( TagPtr  tag) [virtual]

Used to parse an xml-like tag to load parameters and properties.

Reimplemented from core::pack::task::operation::TaskOperation.

void protocols::enzdes::ProteinLigandInterfaceUpweighter::register_options ( ) [static]
void protocols::enzdes::ProteinLigandInterfaceUpweighter::set_weight ( bool const  weight_in) [inline]

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