TrialCompute¶
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class
TrialCompute
¶ Implement the perturbation and calculation of acceptance.
Subclassed by feasst::ComputeAddAVB, feasst::ComputeAddAVBDivalent, feasst::ComputeAddMultiple, feasst::ComputeBeta, feasst::ComputeGCA, feasst::ComputeMorph, feasst::ComputeMoveCluster, feasst::ComputeRemoveAVB, feasst::ComputeRemoveAVBDivalent, feasst::ComputeRemoveMultiple, feasst::TrialComputeAdd, feasst::TrialComputeGrow, feasst::TrialComputeGrowAdd, feasst::TrialComputeGrowRemove, feasst::TrialComputeMove, feasst::TrialComputeRemove
Public Functions
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TrialCompute
(const argtype &args = argtype())¶ args:
new_only: do not compute the Rosenbluth of the old configuration (default: false).
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void
compute_rosenbluth
(const int old, Criteria *criteria, System *system, Acceptance *acceptance, std::vector<TrialStage*> *stages, Random *random)¶ Perform the stages on the system and compute the acceptance.
- Parameters
old
: Set to 1 for “old” system and “0” for new.
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virtual void
perturb_and_acceptance
(Criteria *criteria, System *system, Acceptance *acceptance, std::vector<TrialStage*> *stages, Random *random) = 0¶ Perform the Perturbations and determine acceptance.
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bool
is_new_only
() const¶ Return true if the trial computes new configuration only.
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