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src
protocols
protein_interface_design
filters
InterfaceHolesFilter.hh
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// -*- mode:c++;tab-width:2;indent-tabs-mode:t;show-trailing-whitespace:t;rm-trailing-spaces:t -*-
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// vi: set ts=2 noet:
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//
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// (c) Copyright Rosetta Commons Member Institutions.
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// (c) This file is part of the Rosetta software suite and is made available under license.
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// (c) The Rosetta software is developed by the contributing members of the Rosetta Commons.
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// (c) For more information, see http://www.rosettacommons.org. Questions about this can be
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// (c) addressed to University of Washington UW TechTransfer, email: license@u.washington.edu.
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/// @file protocols/protein_interface_design/filters/InterfaceHolesFilter.hh
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/// @brief Find packing defects at an interface using packstat score terms
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/// @author Jacob Corn (jecorn@u.washington.edu)
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#ifndef INCLUDED_protocols_protein_interface_design_filters_InterfaceHolesFilter_hh
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#define INCLUDED_protocols_protein_interface_design_filters_InterfaceHolesFilter_hh
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#include <
core/pose/Pose.fwd.hh
>
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#include <
core/types.hh
>
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#include <
protocols/filters/Filter.hh
>
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#include <utility/tag/Tag.fwd.hh>
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#include <utility/vector1.hh>
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namespace
protocols {
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namespace
protein_interface_design {
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namespace
filters {
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class
InterfaceHolesFilter
:
public
protocols::filters::Filter
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{
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public
:
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InterfaceHolesFilter
() : protocols::filters::
Filter
(
"InterfaceHoles"
) {}
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InterfaceHolesFilter
(
core::Size
const
rb_jump,
core::Real
const
threshold ) : protocols::filters::
Filter
(
"InterfaceHoles"
) {
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rb_jump_
= rb_jump;
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threshold_
= threshold;
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}
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bool
apply
(
core::pose::Pose
const
& pose )
const
;
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protocols::filters::FilterOP
clone
()
const
{
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return
new
InterfaceHolesFilter
( *
this
);
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}
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protocols::filters::FilterOP
fresh_instance
()
const
{
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return
new
InterfaceHolesFilter
();
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}
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InterfaceHolesFilter
(
InterfaceHolesFilter
const
&
init
) :
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//utility::pointer::ReferenceCount(),
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protocols::filters::
Filter
( init )
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{
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rb_jump_
= init.
rb_jump_
;
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threshold_
= init.
threshold_
;
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};
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void
report
( std::ostream & out,
core::pose::Pose
const
& pose )
const
;
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core::Real
report_sm
(
core::pose::Pose
const
& pose )
const
;
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core::Real
compute
(
core::pose::Pose
const
& pose )
const
;
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virtual
~InterfaceHolesFilter
();
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void
parse_my_tag
(
utility::tag::TagPtr
const
tag,
protocols::moves::DataMap
&,
protocols::filters::Filters_map
const
&,
protocols::moves::Movers_map
const
&,
core::pose::Pose
const
& );
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private
:
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core::Size
rb_jump_
;
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core::Real
threshold_
;
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};
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}
// filters
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}
// protein_interface_design
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}
// protocols
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#endif //INCLUDED_protocols_protein_interface_design_filters_InterfaceHolesFilter_HH_
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