OpenStructure
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include
ost
mol
alg
superpose_frames.hh
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//------------------------------------------------------------------------------
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// This file is part of the OpenStructure project <www.openstructure.org>
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//
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// Copyright (C) 2008-2020 by the OpenStructure authors
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//
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// This library is free software; you can redistribute it and/or modify it under
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// the terms of the GNU Lesser General Public License as published by the Free
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// Software Foundation; either version 3.0 of the License, or (at your option)
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// any later version.
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// This library is distributed in the hope that it will be useful, but WITHOUT
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// ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS
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// FOR A PARTICULAR PURPOSE. See the GNU Lesser General Public License for more
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// details.
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//
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// You should have received a copy of the GNU Lesser General Public License
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// along with this library; if not, write to the Free Software Foundation, Inc.,
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// 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA
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//------------------------------------------------------------------------------
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#ifndef OST_MOL_ALG_SUPERPOSE_FRAMES_HH
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#define OST_MOL_ALG_SUPERPOSE_FRAMES_HH
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#include <
ost/mol/coord_group.hh
>
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#include <
ost/mol/entity_view.hh
>
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#include <
ost/mol/alg/module_config.hh
>
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namespace
ost
{
namespace
mol {
namespace
alg {
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CoordGroupHandle
DLLEXPORT_OST_MOL_ALG
SuperposeFrames
(
CoordGroupHandle
& cg,
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EntityView
& sel,
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int
begin
=0,
int
end
=-1,
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int
ref=-1);
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CoordGroupHandle
DLLEXPORT_OST_MOL_ALG
SuperposeFrames
(
CoordGroupHandle
& cg,
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EntityView
& sel,
EntityView
& ref_view,
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int
begin
=0,
int
end
=-1);
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}}}
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#endif
ost::mol::CoordGroupHandle
coordinate group, for trajectories and such
Definition:
coord_group.hh:39
ost::mol::EntityView
definition of EntityView
Definition:
entity_view.hh:86
coord_group.hh
entity_view.hh
module_config.hh
DLLEXPORT_OST_MOL_ALG
#define DLLEXPORT_OST_MOL_ALG
Definition:
module_config.hh:27
ost::mol::alg::SuperposeFrames
CoordGroupHandle DLLEXPORT_OST_MOL_ALG SuperposeFrames(CoordGroupHandle &cg, EntityView &sel, int begin=0, int end=-1, int ref=-1)
returns a superposed version of coord group, superposed on a reference frame
ost::mol::impl::end
pointer_it< T > end(const std::vector< T > &values)
Definition:
pointer_iterator.hh:79
ost::mol::impl::begin
pointer_it< T > begin(const std::vector< T > &values)
Definition:
pointer_iterator.hh:73
ost
Definition:
base.dox:1
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