PerturbAdd
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class PerturbAdd : public feasst::Perturb
Add a particle to the system.
Public Functions
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PerturbAdd(argtype args = argtype())
args:
delay_add: If true, don’t add particle until finalize (default: true).
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bool delay_add() const
Return if the particle isn’t added until finalized.
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void before_select()
Before perturbation, initialize some optimiation parameters.
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void perturb(System *system, TrialSelect *select, Random *random, const bool is_position_held = false, Acceptance *acceptance = NULL)
Perturb the selection of the system.
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void add(System *system, TrialSelect *select, Random *random, const Position ¢er, const bool is_position_held = false)
Add select to the system.
- param center:
place particle anywhere if center is of zero dimension.
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std::string status_header() const
Print status header.
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std::string status() const
Print status.
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PerturbAdd(argtype args = argtype())