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Rosetta
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#include <protocols/hotspot_hashing/HotspotStubSet.fwd.hh>#include <protocols/hotspot_hashing/HotspotStub.fwd.hh>#include <core/pose/Pose.fwd.hh>#include <core/scoring/ScoreFunction.fwd.hh>#include <core/scoring/TenANeighborGraph.fwd.hh>#include <core/pack/task/PackerTask.fwd.hh>#include <core/conformation/Residue.fwd.hh>#include <core/id/AtomID.fwd.hh>#include <core/scoring/constraints/Constraint.fwd.hh>#include <protocols/filters/Filter.fwd.hh>#include <core/types.hh>#include <utility/VirtualBase.hh>#include <utility/exit.hh>#include <utility/vector1.hh>#include <map>#include <vector>#include <set>#include <utility/io/ozstream.fwd.hh>Classes | |
| class | protocols::hotspot_hashing::HotspotStubSet |
Namespaces | |
| protocols | |
| The instance of Loops contained by AbrelaxApplication should be replaced by a LoopsOP. | |
| protocols::hotspot_hashing | |
Functions | |
| core::scoring::constraints::ConstraintCOPs | protocols::hotspot_hashing::remove_hotspot_constraints_from_pose (core::pose::Pose &) |
| utility function for deleting all backbone stub constraints from a pose. Returns the removed constraints (ambiguous). More... | |
| core::Real | protocols::hotspot_hashing::residue_sc_rmsd_no_super (core::conformation::ResidueCOP res1, core::conformation::ResidueCOP res2, bool const fxnal_group_only=false) |
| utility function to calculate per-residue sidechain rmsd without superposition More... | |
| core::Real | protocols::hotspot_hashing::stub_tgt_angle (core::pose::Pose const &pose, core::conformation::ResidueCOP stub, core::Size const target_res) |
| utility function to make sure stub's Cbeta is not pointed away from the target. Returns true if stub is pointed generally towards target's center of mass. Returns false otherwise. algorithm: get vector between CA and target center of mass, then CA-CB vector. Check alignment between the two. doesn't take into account hotspots at the end of the pose so might be a little off in CoM. But probably pretty OK More... | |
1.9.1