Reaction Coordinates and Mechanistic Hypothesis Tests

Annual Review of Physical Chemistry

Volumn 67, Issue , 2016, Pages 669-690

  Peters, Baron ^a,b  

^a University of California   (United States)

^b UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

Collective variable; Committor; Dimensionality reduction; Likelihood maximization; Transition path sampling; Transmission coefficient

Indexed keywords

DYNAMICAL SYSTEMS; ELECTRONIC STATES; FREE ENERGY; REACTION RATES; SAMPLING; TESTING; TRAJECTORIES;

COLLECTIVE VARIABLES; COMMITTOR; CONDITION; DIMENSIONALITY REDUCTION; LIKELIHOOD MAXIMIZATION; MECHANISTICS; REACTION COORDINATES; TRAJECTORY-BASED; TRANSITION PATH SAMPLING; TRANSMISSION COEFFICIENTS;

EIGENVALUES AND EIGENFUNCTIONS;

EID: 84973320145     PISSN: 0066426X     EISSN: 15451593     Source Type: Book Series    
DOI: 10.1146/annurev-physchem-040215-112215     Document Type: Article

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