Nontargeted Parallel Cascade Selection Molecular Dynamics Based on a Nonredundant Selection Rule for Initial Structures Enhances Conformational Sampling of Proteins - researchr publication

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Ryuhei Harada, Vladimír Sládek, Yasuteru Shigeta. Nontargeted Parallel Cascade Selection Molecular Dynamics Based on a Nonredundant Selection Rule for Initial Structures Enhances Conformational Sampling of Proteins. Journal of Chemical Information and Computer Sciences, 59(12):5198-5206, 2019. [doi]

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