Abstract
Molecular dynamics simulations are used to study helix formation in a simple model polymer chain that is subject to excluded volume and torsional interactions. The changing conformations exhibited by chains of different lengths under gradual cooling are followed until each reaches a state from which no further change is possible. The interactions are chosen so that the true ground state is a helix, and a high proportion of the simulation runs do succeed in reaching this state.
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© 2004 Springer-Verlag Berlin Heidelberg
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Rapaport, D.C. (2004). Folding Polymer Chains. In: Landau, D.P., Lewis, S.P., Schüttler, HB. (eds) Computer Simulation Studies in Condensed-Matter Physics XVI. Springer Proceedings in Physics, vol 95. Springer, Berlin, Heidelberg. https://doi.org/10.1007/978-3-642-59293-5_20
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DOI: https://doi.org/10.1007/978-3-642-59293-5_20
Publisher Name: Springer, Berlin, Heidelberg
Print ISBN: 978-3-642-63923-4
Online ISBN: 978-3-642-59293-5
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