IMP Reference Guide
develop.714915d50b,2024/12/07
The Integrative Modeling Platform
|
Apply a mover that moves particles inside the unit cell. More...
#include <IMP/spb/CellMover.h>
Apply a mover that moves particles inside the unit cell.
The mover takes into account the fact that the unit cell size changes from one step to the next.
Definition at line 25 of file CellMover.h.
Public Member Functions | |
CellMover (Particle *p, Particles ps, Float max_translation) | |
virtual std::string | get_type_name () const override |
virtual ::IMP::VersionInfo | get_version_info () const override |
Get information about the module and version of the object. More... | |
void | show (std::ostream &out=std::cout) const |
Public Member Functions inherited from IMP::core::MonteCarloMover | |
MonteCarloMover (Model *m, std::string name) | |
void | accept () |
Accept/commit any changes made to the Particles. More... | |
MonteCarloMoverResult | propose () |
Propose a modification. More... | |
void | reject () |
Roll back any changes made to the Particles. More... | |
unsigned int | get_number_of_proposed () const |
unsigned int | get_number_of_accepted () const |
void | reset_statistics () |
Public Member Functions inherited from IMP::ModelObject | |
ModelObject (Model *m, std::string name) | |
bool | get_has_dependencies () const |
Return whether this object has dependencies computed. More... | |
bool | get_has_required_score_states () const |
Return whether score states are computed. More... | |
ModelObjectsTemp | get_inputs () const |
ModelObjectsTemps | get_interactions () const |
Get the interacting sets induced by this ModelObject. More... | |
Model * | get_model () const |
ModelObjectsTemp | get_outputs () const |
const ScoreStatesTemp & | get_required_score_states () const |
Get the score states that are ancestors of this in the dependency graph. More... | |
void | set_has_dependencies (bool tf) |
Either invalidate the dependencies or ensure they are correct. More... | |
void | set_has_required_score_states (bool tf) |
Compute the required score states. More... | |
Public Member Functions inherited from IMP::Object | |
virtual void | clear_caches () |
CheckLevel | get_check_level () const |
LogLevel | get_log_level () const |
void | set_check_level (CheckLevel l) |
void | set_log_level (LogLevel l) |
Set the logging level used in this object. More... | |
void | set_was_used (bool tf) const |
void | show (std::ostream &out=std::cout) const |
const std::string & | get_name () const |
void | set_name (std::string name) |
Protected Member Functions | |
virtual IMP::ModelObjectsTemp | do_get_inputs () const override |
virtual core::MonteCarloMoverResult | do_propose () override |
Implement propose_move() More... | |
virtual void | do_reject () override |
Implement reset_proposed_move() More... | |
Protected Member Functions inherited from IMP::core::MonteCarloMover | |
virtual void | do_accept () |
Implement accept_proposed_move(); default implementation is empty. More... | |
virtual ModelObjectsTemp | do_get_outputs () const override |
Protected Member Functions inherited from IMP::ModelObject | |
virtual ModelObjectsTemps | do_get_interactions () const |
virtual void | handle_set_has_required_score_states (bool) |
Protected Member Functions inherited from IMP::Object | |
Object (std::string name) | |
Construct an object with the given name. More... | |
virtual void | do_destroy () |
|
overrideprotectedvirtual |
Get any Particle, Container or other ModelObjects read by this during evaluation. If you read everything in a container, you can just return that container.
Implements IMP::ModelObject.
|
overrideprotectedvirtual |
Implement propose_move()
Implements IMP::core::MonteCarloMover.
|
overrideprotectedvirtual |
Implement reset_proposed_move()
Implements IMP::core::MonteCarloMover.
|
overridevirtual |
Get information about the module and version of the object.
Reimplemented from IMP::Object.
Definition at line 35 of file CellMover.h.