Removing external degrees of freedom from transition-state search methods using quaternions

Journal of Chemical Theory and Computation

Volumn 11, Issue 3, 2015, Pages 1055-1062

  Melander, Marko ^a   Laasonen, Kari ^a   Jónsson, Hannes ^a,b  

^a AALTO UNIVERSITY   (Finland)

^b UNIVERSITY OF ICELAND   (Iceland)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84924415552     PISSN: 15499618     EISSN: 15499626     Source Type: Journal    
DOI: 10.1021/ct501155k     Document Type: Article

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