@inbook{b7963bced9f4402499a2335d80eddecb,

title = "Nonbonded Computations",

abstract = "Reducing the cost of the nonbonded energy and force computations is of primary importance in molecular mechanics and dynamics simulations of biomolecules. This is because the direct evaluation of these nonbonded interactions involving all atom pairs has the complexity of (formula presented) where N is the number of atoms. Recall that the bonded terms are local and thus have a linear computational complexity; see homework assignment 8 for a related exercise.",

keywords = "Brownian Dynamic, Fast Multipole Method, Multipole Expansion, Nonbonded Interaction, Spherical Harmonic Function",

author = "Tamar Schlick",

note = "Publisher Copyright: {\textcopyright} 2010, Springer Science+Business Media, LLC. Copyright: Copyright 2020 Elsevier B.V., All rights reserved.",

year = "2010",

doi = "10.1007/978-1-4419-6351-2_10",

language = "English (US)",

series = "Interdisciplinary Applied Mathematics",

publisher = "Springer Nature",

pages = "299--344",

booktitle = "Interdisciplinary Applied Mathematics",

address = "United States",

}