An Inverse Equilibrium Maximum Entropy Algorithm Applied to Proteins

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dc.creatorDonohue, John P.
dc.date2003-06-03
dc.date.accessioned2026-07-07T05:49:20Z
dc.date.available2026-07-07T05:49:20Z
dc.descriptionA computational method is developed to work on an inverse equilibrium problem with an interest towards applications with protein folding. In general, we are given a set of equilibrium confgiurations and want to derive the most probable potential function that results in these configurations. The method is applied to polymer simulations and a simple model of proteins using protein structures obtained from the Protein Data Bank http://www.rcsb.org/pdb The resulting energy function is tested on a few decoy sets with limited success.
dc.description10 pages, 2 postscript figures
dc.identifierhttps://arxiv.org/abs/physics/0306030
dc.identifierhttp://arxiv.org/abs/physics/0306030
dc.identifier.urihttp://salesiana.dossiersoluciones.com/handle/123456789/85353
dc.subjectBiological Physics
dc.subjectComputational Physics
dc.subjectQuantitative Methods
dc.titleAn Inverse Equilibrium Maximum Entropy Algorithm Applied to Proteins
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