Efficient path sampling on multiple reaction channels

Computer Physics Communications

Volumn 179, Issue 1-3, 2008, Pages 34-40

  van Erp, Titus S ^a  

^a UNIVERSITY OF LEUVEN   (Belgium)

Author keywords

Multiple reaction channels; Path sampling; Rare events; Transition interface sampling

Indexed keywords

ALGORITHMS; MOLECULAR DYNAMICS; PARALLEL PROCESSING SYSTEMS; PROBLEM SOLVING;

MULTIPLE REACTION CHANNELS; PATH SAMPLING; RARE EVENTS; TRANSITION INTERFACE SAMPLING;

MOTION PLANNING;

EID: 44649160825     PISSN: 00104655     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cpc.2008.01.023     Document Type: Article

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