Sampling Long- versus Short-Range Interactions Defines the Ability of Force Fields To Reproduce the Dynamics of Intrinsically Disordered Proteins-Reference-Cited by-同舟云学术

Sampling Long- versus Short-Range Interactions Defines the Ability of Force Fields To Reproduce the Dynamics of Intrinsically Disordered Proteins

Published:2017-08-28 Issue:9 Volume:13 Page:3964-3974
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Mercadante Davide¹²^ORCID,Wagner Johannes A.¹^ORCID,Aramburu Iker V.³,Lemke Edward A.³,Gräter Frauke¹²^ORCID

Affiliation:

1. HITS—Heidelberg Institute for Theoretical Studies, 35 Schloß Wolfsbrunnenweg, 69118 Heidelberg, Germany

2. IWR—Interdisciplinary Center for Scientific Computing, Heidelberg University, Mathematikon, Im Neuenheimer Feld 205, 69120 Heidelberg, Germany

3. Structural and Computational Biology Unit, Cell Biology and Biophysics Unit, European Molecular Biology Laboratory (EMBL), Meyerhofstraße 1, 69117 Heidelberg, Germany

Funder

Klaus Tschira Stiftung

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.7b00143

Reference54 articles.

1. Intrinsically disordered proteins: regulation and disease

2. Orderly order in protein intrinsic disorder distribution: disorder in 3500 proteomes from viruses and the three domains of life

3. Linking folding and binding

4. Comparison of Structure Determination Methods for Intrinsically Disordered Amyloid-β Peptides

5. Describing sequence–ensemble relationships for intrinsically disordered proteins

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