protocols::ligand_docking::Transform_info Struct Reference

#include <Transform.hh>

Public Member Functions
	Transform_info ()=default

Public Attributes
std::string	chain = ""
core::Real	move_distance = 0.0
core::Real	box_size = 0.0
core::Real	angle = 0.0
core::Real	rmsd = 0.0
core::Size	cycles = 0
core::Real	temperature = 0.0
core::Size	repeats = 1

Constructor & Destructor Documentation

Transform_info()

protocols::ligand_docking::Transform_info::Transform_info ( )

default

Member Data Documentation

angle

core::Real protocols::ligand_docking::Transform_info::angle = 0.0

Referenced by protocols::ligand_docking::Transform::parse_my_tag(), protocols::ligand_docking::Transform::Transform(), and protocols::ligand_docking::Transform::transform_ligand().

box_size

core::Real protocols::ligand_docking::Transform_info::box_size = 0.0

Referenced by protocols::ligand_docking::Transform::apply(), protocols::ligand_docking::Transform::check_grid(), protocols::ligand_docking::Transform::parse_my_tag(), and protocols::ligand_docking::Transform::Transform().

chain

std::string protocols::ligand_docking::Transform_info::chain = ""

Referenced by protocols::ligand_docking::Transform::apply(), protocols::ligand_docking::Transform::make_multi_pose_grids(), protocols::ligand_docking::Transform::parse_my_tag(), and protocols::ligand_docking::Transform::Transform().

cycles

core::Size protocols::ligand_docking::Transform_info::cycles = 0

Referenced by protocols::ligand_docking::Transform::apply(), protocols::ligand_docking::Transform::estimate_mc_travel(), protocols::ligand_docking::Transform::parse_my_tag(), and protocols::ligand_docking::Transform::Transform().

move_distance

core::Real protocols::ligand_docking::Transform_info::move_distance = 0.0

Referenced by protocols::ligand_docking::Transform::estimate_mc_travel(), protocols::ligand_docking::Transform::parse_my_tag(), protocols::ligand_docking::Transform::Transform(), and protocols::ligand_docking::Transform::transform_ligand().

repeats

core::Size protocols::ligand_docking::Transform_info::repeats = 1

Referenced by protocols::ligand_docking::Transform::apply(), and protocols::ligand_docking::Transform::parse_my_tag().

rmsd

core::Real protocols::ligand_docking::Transform_info::rmsd = 0.0

Referenced by protocols::ligand_docking::Transform::check_rmsd(), and protocols::ligand_docking::Transform::parse_my_tag().

temperature

core::Real protocols::ligand_docking::Transform_info::temperature = 0.0

Referenced by protocols::ligand_docking::Transform::apply(), protocols::ligand_docking::Transform::parse_my_tag(), and protocols::ligand_docking::Transform::Transform().

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

• src/protocols/ligand_docking/Transform.hh