Open AccessImplementations of Nosé–Hoover and Nosé–Poincaré thermostats in mesoscopic dynamic simulations with the united-residue model of a polypeptide chain
Author(s) -
Dana S. Kleinerman,
Cezary Czaplewski,
Adam Liwo,
Harold A. Scheraga
Publication year - 2008
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.2943146
Subject(s) - thermostat , molecular dynamics , phase space , canonical ensemble , statistical physics , microcanonical ensemble , propagator , langevin dynamics , physics , classical mechanics , mathematics , thermodynamics , monte carlo method , mathematical physics , quantum mechanics , statistics
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