The OPEP coarse-grained protein model has been applied to a wide range of applications since its first release 15 years ago. The model, which combines energetic and structural accuracy and chemical specificity, allows the study of single protein properties, DNA-RNA complexes, amyloid fibril formation and protein suspensions in a crowded environment. Here we first review the current state of the model and the most exciting applications using advanced conformational sampling methods. We then present the current limitations and a perspective on the ongoing developments. © 2014 The Royal Society of Chemistry.

The OPEP coarse-grained protein model: from single molecules, amyloid formation, and suspension in a crowded environment to RNA/DNA complexes

S Melchionna;
2014

Abstract

The OPEP coarse-grained protein model has been applied to a wide range of applications since its first release 15 years ago. The model, which combines energetic and structural accuracy and chemical specificity, allows the study of single protein properties, DNA-RNA complexes, amyloid fibril formation and protein suspensions in a crowded environment. Here we first review the current state of the model and the most exciting applications using advanced conformational sampling methods. We then present the current limitations and a perspective on the ongoing developments. © 2014 The Royal Society of Chemistry.
2014
Istituto per i Processi Chimico-Fisici - IPCF
Inglese
43
4871
4893
protein simulations
coarse-graining
1
info:eu-repo/semantics/article
262
F. Sterpone; S. Melchionna; P. Tuffery; S. Pasquali; N. Mousseau; T. Cragnolini; Y. Chebaro; J.F. SaintPierre; M. Kalimeri; A. Barducci; Y. Laurin; A....espandi
01 Contributo su Rivista::01.01 Articolo in rivista
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/20.500.14243/257093
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