A New Efficient Method for Generating Conformations of Unfolded Proteins with Diverse Main-Chain Dihedral-Angle Distributions

A new method for generating polypeptide-chain conformations has been developed for studying structural characteristics of unfolded proteins. It enables us to generate a large number of conformations very rapidly by avoiding atomic collisions efficiently with the use of main-chain dihedral-angle dist...

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Veröffentlicht in:Journal of chemical theory and computation 2011-07, Vol.7 (7), p.2126-2136
Hauptverfasser: Seki, Yasutaka, Shimbo, Yudai, Nonaka, Takamasa, Soda, Kunitsugu
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Sprache:eng
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