On the relationship between NMR-derived amide order parameters and protein backbone entropy changes

Correlation as a Determinant of Configurational Entropy in Supramolecular and Protein Systems

(2014) Andrew T. Fenley et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Loss of conformational entropy in protein folding calculated using realistic ensembles and its implications for NMR-based calculations

(2014) M. C. Baxa et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Conformational Contribution to Thermodynamics of Binding in Protein-Peptide Complexes through Microscopic Simulation

(2013) Amit Das et al.   BIOPHYSICAL JOURNAL

Microscopic Insights into the NMR Relaxation-Based Protein Conformational Entropy Meter

(2013) Vignesh Kasinath et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The dark energy of proteins comes to light: conformational entropy and its role in protein function revealed by NMR relaxation

(2012) A Joshua Wand   CURRENT OPINION IN STRUCTURAL BIOLOGY

Efficient Calculation of Molecular Configurational Entropies Using an Information Theoretic Approximation

(2012) Bracken M. King et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Context and Force Field Dependence of the Loss of Protein Backbone Entropy upon Folding Using Realistic Denatured and Native State Ensembles

(2012) Michael C. Baxa et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Coupled Motion in Proteins Revealed by Pressure Perturbation

(2012) Yinan Fu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Protein activity regulation by conformational entropy

(2012) Shiou-Ru Tzeng et al.   NATURE

Entropy Localization in Proteins

(2010) Da-Wei Li et al.   JOURNAL OF PHYSICAL CHEMISTRY B

The role of conformational entropy in molecular recognition by calmodulin

(2010) Michael S Marlow et al.   Nature Chemical Biology

Absolute Single-Molecule Entropies from Quasi-Harmonic Analysis of Microsecond Molecular Dynamics: Correction Terms and Convergence Properties

(2009) Riccardo Baron et al.   Journal of Chemical Theory and Computation

CHARMM: The biomolecular simulation program

(2009) B. R. Brooks et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Certification of Molecular Dynamics Trajectories with NMR Chemical Shifts

(2009) Da-Wei Li et al.   Journal of Physical Chemistry Letters

Short-Range Coherence of Internal Protein Dynamics Revealed by High-Precision in Silico Study

(2009) Da-Wei Li et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Protein Side-Chain Dynamics and Residual Conformational Entropy

(2008) Nikola Trbovic et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY