Microstructural Models of Interactions That Govern Protein Conformations: Algorithms for High Performance Computer Architectures

Abstract

The objective of this project was to apply computational methods for microstructures suspended in a viscous liquid, to the calculation of slow dynamics in protein folding and association reactions. A fast Brownian dynamics algorithm was developed, as well as a knowledge-based potential of mean force for interactions protein segments.

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Document Details

Document Type
Technical Report
Publication Date
Jan 01, 1998
Accession Number
ADA360981

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  • Sangtae Kim

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  • University of Wisconsin–Madison

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  • Materials and Manufacturing Processes

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