openmmtools.multistate.ParallelTemperingAnalyzer ================================================ .. currentmodule:: openmmtools.multistate .. autoclass:: ParallelTemperingAnalyzer .. automethod:: __init__ .. rubric:: Methods .. autosummary:: ~ParallelTemperingAnalyzer.__init__ ~ParallelTemperingAnalyzer.clear ~ParallelTemperingAnalyzer.generate_mixing_statistics ~ParallelTemperingAnalyzer.get_effective_energy_timeseries ~ParallelTemperingAnalyzer.get_enthalpy ~ParallelTemperingAnalyzer.get_entropy ~ParallelTemperingAnalyzer.get_free_energy ~ParallelTemperingAnalyzer.read_energies ~ParallelTemperingAnalyzer.read_logZ ~ParallelTemperingAnalyzer.read_log_weights ~ParallelTemperingAnalyzer.reformat_energies_for_mbar ~ParallelTemperingAnalyzer.show_mixing_statistics .. rubric:: Attributes .. autosummary:: ~ParallelTemperingAnalyzer.effective_length ~ParallelTemperingAnalyzer.has_log_weights ~ParallelTemperingAnalyzer.kT ~ParallelTemperingAnalyzer.max_n_iterations ~ParallelTemperingAnalyzer.mbar ~ParallelTemperingAnalyzer.n_equilibration_iterations ~ParallelTemperingAnalyzer.n_iterations ~ParallelTemperingAnalyzer.n_replicas ~ParallelTemperingAnalyzer.n_states ~ParallelTemperingAnalyzer.name ~ParallelTemperingAnalyzer.observables ~ParallelTemperingAnalyzer.reference_states ~ParallelTemperingAnalyzer.reporter ~ParallelTemperingAnalyzer.restraint_distance_cutoff ~ParallelTemperingAnalyzer.restraint_energy_cutoff ~ParallelTemperingAnalyzer.statistical_inefficiency ~ParallelTemperingAnalyzer.unbias_restraint ~ParallelTemperingAnalyzer.use_full_trajectory ~ParallelTemperingAnalyzer.use_online_data