From transition paths to transition states and rate coefficients

Journal of Chemical Physics

Volumn 120, Issue 2, 2004, Pages 516-523

  Hummer, Gerhard ^a  

^a NATIONAL INSTITUTES OF HEALTH   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALGORITHMS; BOUNDARY CONDITIONS; COMPUTER SIMULATION; DIFFUSION; FREE ENERGY; GREEN'S FUNCTION; MONTE CARLO METHODS; PROBABILITY DENSITY FUNCTION; RANDOM PROCESSES; RATE CONSTANTS; VECTORS;

LANGEVIN DYNAMICS; MAXWELL-BOLTZMANN VELOCITY EQUATION; RATE COEFFICIENTS; SMOLUCHOWSKI EQUATION; TRANSITION PATH; TRANSITION STATES;

PHASE TRANSITIONS;

BIOPOLYMER; SOLVENT;

ALGORITHM; ARTICLE; CHEMICAL MODEL; CHEMISTRY; COMPUTER SIMULATION; DRUG MIXTURE; KINETICS; PHASE TRANSITION; STATISTICAL MODEL;

ALGORITHMS; BIOPOLYMERS; CHEMISTRY; COMPLEX MIXTURES; COMPUTER SIMULATION; KINETICS; MODELS, CHEMICAL; MODELS, STATISTICAL; PHASE TRANSITION; SOLVENTS;

EID: 0842311640     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1630572     Document Type: Article

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