Literature DB >> 26203016

Efficient maximum likelihood parameterization of continuous-time Markov processes.

Robert T McGibbon1, Vijay S Pande1.   

Abstract

Continuous-time Markov processes over finite state-spaces are widely used to model dynamical processes in many fields of natural and social science. Here, we introduce a maximum likelihood estimator for constructing such models from data observed at a finite time interval. This estimator is dramatically more efficient than prior approaches, enables the calculation of deterministic confidence intervals in all model parameters, and can easily enforce important physical constraints on the models such as detailed balance. We demonstrate and discuss the advantages of these models over existing discrete-time Markov models for the analysis of molecular dynamics simulations.

Mesh:

Year:  2015        PMID: 26203016      PMCID: PMC4514821          DOI: 10.1063/1.4926516

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


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