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A New Approach to Rigid Body Minimization with Application to Molecular Docking

Our work is motivated by energy minimization in the space of rigid affine transformations of macromolecules, an essential step in computational protein-protein docking. We introduce a novel representation of rigid body motion that leads to a natural formulation of the energy minimization problem as...

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Bibliografiske detaljer
Main Authors: Mirzaei, Hanieh, Kozakov, Dima, Beglov, Dmitri, Paschalidis, Ioannis Ch., Vajda, Sandor, Vakili, Pirooz
Format: Artigo
Sprog:Inglês
Udgivet: 2012
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC3992991/
https://ncbi.nlm.nih.gov/pubmed/24763338
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1109/CDC.2012.6426267
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