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Evolution of all-atom protein force fields to improve local and global properties

Experimental studies on intrinsically disordered and unfolded proteins have shown that in isolation they typically have low populations of secondary structure, and exhibit distance scaling suggesting they are at near theta-solvent conditions. Until recently however, all-atom force fields failed to r...

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Foilsithe in:J Phys Chem Lett
Main Authors: Zerze, Gül H., Zheng, Wenwei, Best, Robert B., Mittal, Jeetain
Formáid: Artigo
Teanga:Inglês
Foilsithe: 2019
Ábhair:
Rochtain Ar Líne:https://ncbi.nlm.nih.gov/pmc/articles/PMC7507668/
https://ncbi.nlm.nih.gov/pubmed/30990694
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpclett.9b00850
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