The MaxFlux algorithm for calculating variationally optimized reaction paths for conformational transitions in many body systems at finite temperature

Journal of Chemical Physics

Volumn 107, Issue 13, 1997, Pages 5000-5006

  Huo, Shuanghong ^a   Straub, John E ^a  

^a Boston University ^*  (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALGORITHMS; CALCULATIONS; DYNAMICS; FRICTION; MATHEMATICAL MODELS; REACTION KINETICS; TEMPERATURE;

COMPUTATIONAL PROTOCOL; CONFORMATIONAL TRANSITIONS; MAXFLUX ALGORITHM; REACTION PATHS;

CHEMICAL REACTIONS;

EID: 0031256658     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.474863     Document Type: Article

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