A strategy for analysis of (molecular) equilibrium simulations: Configuration space density estimation, clustering and visualization

F. A. Hamprecht, C. Peter, X. Daura, W. Thiel, W. F. van Gunsteren

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Cite this

@article{7d951b2543ea4f06b2d28f09b9fcb4cb,

title = "A strategy for analysis of (molecular) equilibrium simulations: Configuration space density estimation, clustering and visualization",

author = "Hamprecht, {F. A.} and C. Peter and X. Daura and W. Thiel and Gunsteren, {W. F. van}",

year = "2001",

month = jan,

day = "1",

language = "English",

volume = "114",

pages = "2079--2089",

journal = "Journal of Chemical Physics",

issn = "0021-9606",

publisher = "American Institute of Physics",

}

TY - JOUR

T1 - A strategy for analysis of (molecular) equilibrium simulations: Configuration space density estimation, clustering and visualization

AU - Hamprecht, F. A.

AU - Peter, C.

AU - Daura, X.

AU - Thiel, W.

AU - Gunsteren, W. F. van

PY - 2001/1/1

Y1 - 2001/1/1

M3 - Article

VL - 114

SP - 2079

EP - 2089

JO - Journal of Chemical Physics

JF - Journal of Chemical Physics

SN - 0021-9606

ER -