"Efficient evaluation of sampling quality of molecular dynamics simulations ..."

Stephan Frickenhaus, Srinivasaraghavan Kannan, Martin Zacharias (2009)

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DOI: 10.1002/JCC.21076

access: closed

type: Journal Article

metadata version: 2020-04-01

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Stephan Frickenhaus, Srinivasaraghavan Kannan, Martin Zacharias:
Efficient evaluation of sampling quality of molecular dynamics simulations by clustering of dihedral torsion angles and Sammon mapping. J. Comput. Chem. 30(3): 479-492 (2009)

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