Locating all transition states and studying the reaction pathways of potential energy surfaces

Journal of Chemical Physics

Volumn 110, Issue 18, 1999, Pages 9259-9295

  Westerberg, K M ^a   Floudas, C A ^a  

^a Princeton University   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALANINE DIPEPTIDES; CONFORMATIONAL ENERGIES; DISCONNECTIVITY GRAPHS; GLOBAL OPTIMIZATION ALGORITHM; OCCUPATION PROBABILITY; OPTIMIZATION METHOD; REACTION PATHWAYS; THEORETICAL GUARANTEES;

ALGORITHMS; AMINO ACIDS; GLOBAL OPTIMIZATION; LINEAR PROGRAMMING; POTENTIAL ENERGY SURFACES;

QUANTUM CHEMISTRY;

EID: 84863091360     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.478850     Document Type: Article

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