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Perspective: Coarse-grained models for biomolecular systems
WG Noid - The Journal of chemical physics, 2013 - pubs.aip.org
By focusing on essential features, while averaging over less important details, coarse-
grained (CG) models provide significant computational and conceptual advantages with …
grained (CG) models provide significant computational and conceptual advantages with …
Global dynamics of proteins: bridging between structure and function
Biomolecular systems possess unique, structure-encoded dynamic properties that underlie
their biological functions. Recent studies indicate that these dynamic properties are …
their biological functions. Recent studies indicate that these dynamic properties are …
[LIVRO][B] Coarse-graining of condensed phase and biomolecular systems
GA Voth - 2008 - taylorfrancis.com
Exploring recent developments in the field, Coarse-Graining of Condensed Phase and
Biomolecular Systems examines systematic ways of constructing coarse-grained …
Biomolecular Systems examines systematic ways of constructing coarse-grained …
Integrative, dynamic structural biology at atomic resolution—it's about time
Biomolecules adopt a dynamic ensemble of conformations, each with the potential to
interact with binding partners or perform the chemical reactions required for a multitude of …
interact with binding partners or perform the chemical reactions required for a multitude of …
Structure of the full-length Shaker potassium channel Kv1. 2 by normal-mode-based X-ray crystallographic refinement
Voltage-dependent potassium channels (Kv) are homotetramers composed of four voltage
sensors and one pore domain. Because of high-level structural flexibility, the first …
sensors and one pore domain. Because of high-level structural flexibility, the first …
Combining efficient conformational sampling with a deformable elastic network model facilitates structure refinement at low resolution
Structural studies of large proteins and protein assemblies are a difficult and pressing
challenge in molecular biology. Experiments often yield only low-resolution or sparse data …
challenge in molecular biology. Experiments often yield only low-resolution or sparse data …
[HTML][HTML] Normal mode analysis as a routine part of a structural investigation
JA Bauer, J Pavlović, V Bauerová-Hlinková - Molecules, 2019 - mdpi.com
Normal mode analysis (NMA) is a technique that can be used to describe the flexible states
accessible to a protein about an equilibrium position. These states have been shown …
accessible to a protein about an equilibrium position. These states have been shown …
X-ray scattering studies of protein structural dynamics
X-ray scattering is uniquely suited to the study of disordered systems and thus has the
potential to provide insight into dynamic processes where diffraction methods fail. In …
potential to provide insight into dynamic processes where diffraction methods fail. In …
Biomolecular dynamics: order–disorder transitions and energy landscapes
While the energy landscape theory of protein folding is now a widely accepted view for
understanding how relatively weak molecular interactions lead to rapid and cooperative …
understanding how relatively weak molecular interactions lead to rapid and cooperative …
Evolution of complex RNA polymerases: the complete archaeal RNA polymerase structure
Y Korkhin, UM Unligil, O Littlefield, PJ Nelson… - PLoS …, 2009 - journals.plos.org
The archaeal RNA polymerase (RNAP) shares structural similarities with eukaryotic RNAP II
but requires a reduced subset of general transcription factors for promoter-dependent …
but requires a reduced subset of general transcription factors for promoter-dependent …