Coarse master equation from Bayesian analysis of replica molecular dynamics simulations

Journal of Physical Chemistry B

Volumn 109, Issue 14, 2005, Pages 6479-6484

  Sriraman, Saravanapriyan ^a   Kevrekidis, Ioannis G ^a,b   Hummer, Gerhard ^c  

^a Princeton University   (United States)

^b PRINCETON UNIVERSITY   (United States)

^c NATIONAL INSTITUTE OF DIABETES AND DIGESTIVE AND KIDNEY DISEASES   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BAYESIAN ANALYSIS; COARSE MASTER EQUATIONS; MARKOVIAN MASTER EQUATION; REPLICA MOLECULAR DYNAMIC SIMULATIONS;

COMPUTER SIMULATION; FREE ENERGY; MARKOV PROCESSES; MATRIX ALGEBRA; PROBABILITY; REACTION KINETICS; THERMODYNAMIC PROPERTIES;

MOLECULAR DYNAMICS;

CARBON NANOTUBE; WATER;

ARTICLE; BAYES THEOREM; CHEMISTRY; COMPUTER SIMULATION; KINETICS; METHODOLOGY; PHYSICAL CHEMISTRY; PROBABILITY; STATISTICAL MODEL; THEORETICAL MODEL; THERMODYNAMICS;

BAYES THEOREM; CHEMISTRY, PHYSICAL; COMPUTER SIMULATION; KINETICS; LIKELIHOOD FUNCTIONS; MARKOV CHAINS; MODELS, STATISTICAL; MODELS, THEORETICAL; NANOTUBES, CARBON; THERMODYNAMICS; WATER;

EID: 17444389688     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp046448u     Document Type: Article

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