The IDP-Specific Force Field ff14IDPSFF Improves the Conformer Sampling of Intrinsically Disordered Proteins

Intrinsically disordered proteins (IDPs) or intrinsically disordered regions do not have a fixed tertiary structure but play key roles in signal regulation, molecule recognition, and drug targeting. However, it is difficult to study the structure and function of IDPs by traditional experimental meth...

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Veröffentlicht in:	Journal of chemical information and modeling 2017-05, Vol.57 (5), p.1166-1178
Hauptverfasser:	Song, Dong, Luo, Ray, Chen, Hai-Feng
Format:	Artikel
Sprache:	eng
Schlagworte:	Amino acids Computer Simulation HIV - chemistry Intrinsically Disordered Proteins - chemistry Models, Biological Molecular Dynamics Simulation NMR Nuclear magnetic resonance Peptides Protein Folding Proteins Residues Sampling Simulation Solvents - chemistry Stress concentration
Online-Zugang:	Volltext
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