Adaptive spectral clustering with application to tripeptide conformation analysis

Journal of Chemical Physics

Volumn 139, Issue 19, 2013, Pages

  Haack, Fiete ^a   Fackeldey, Konstantin ^b   Röblitz, Susanna ^b   Scharkoi, Olga ^b   Weber, Marcus ^b   Schmidt, Burkhard ^c  

^a UNIVERSITY OF ROSTOCK   (Germany)

^b ZUSE INSTITUTE BERLIN   (Germany)

^c FREIE UNIVERSITÄT BERLIN   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

ADAPTIVE DECOMPOSITION; CONFORMATION ANALYSIS; DYNAMICAL BEHAVIORS; MOLECULAR CONFORMATIONAL SPACE; MULTIPLE CONFORMATIONS; SPECTRAL CLUSTERING; TRANSITION PROBABILITIES; TRANSITION PROBABILITY MATRIX;

CLUSTERING ALGORITHMS;

CONFORMATIONS;

OLIGOPEPTIDE;

ALGORITHM; ARTICLE; MOLECULAR DYNAMICS; PROTEIN CONFORMATION;

ALGORITHMS; MOLECULAR DYNAMICS SIMULATION; OLIGOPEPTIDES; PROTEIN CONFORMATION;

EID: 84903367079     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4830409     Document Type: Article

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