Adaptive spectral clustering for conformation analysis

Skeletal structure of Z-Aib-Pro-NHMe model peptide. Arrows indicate twelve dihedral angles along the backbone characterizing the molecular conformation.

Fiete Haack, Susanna Röblitz, Olga Scharkoi, Burkhard Schmidt, and Marcus Weber

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Proceedings of 8th International Conference of Numerical Analysis and Applied Mathematics
(Rhodos, Sep. 19-25, 2010)
AIP Conf. Proc. 1281, 1585-1588 (2010)
DOI:10.1063/1.3498116
Eds.: Th. E. Simos, G. Psihoyios, and Ch. Tsitouras