相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。Characterization of the lnterdomain Motions in Hen Lysozyme Using Residual Dipolar Couplings as Replica-Averaged Structural Restraints in Molecular Dynamics Simulations
Alfonso De Simone et al.
BIOCHEMISTRY (2013)
Structures of the Excited States of Phospholamban and Shifts in Their Populations upon Phosphorylation
Alfonso De Simone et al.
BIOCHEMISTRY (2013)
On the statistical equivalence of restrained-ensemble simulations with the maximum entropy method
Benoit Roux et al.
JOURNAL OF CHEMICAL PHYSICS (2013)
Molecular dynamics simulations with replica-averaged structural restraints generate structural ensembles according to the maximum entropy principle
Andrea Cavalli et al.
JOURNAL OF CHEMICAL PHYSICS (2013)
Allosteric inhibition through suppression of transient conformational states
Shiou-Ru Tzeng et al.
NATURE CHEMICAL BIOLOGY (2013)
NMR paves the way for atomic level descriptions of sparsely populated, transiently formed biomolecular conformers
Ashok Sekhar et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2013)
Determination of structural fluctuations of proteins from structure-based calculations of residual dipolar couplings
Rinaldo W. Montalvao et al.
JOURNAL OF BIOMOLECULAR NMR (2012)
On the Use of Experimental Observations to Bias Simulated Ensembles
Jed W. Pitera et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2012)
Structure of an Intermediate State in Protein Folding and Aggregation
Philipp Neudecker et al.
SCIENCE (2012)
Determination of Conformational Equilibria in Proteins Using Residual Dipolar Couplings
Alfonso De Simone et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2011)
Solution structure of a minor and transiently formed state of a T4 lysozyme mutant
Guillaume Bouvignies et al.
NATURE (2011)
SPARTA plus : a modest improvement in empirical NMR chemical shift prediction by means of an artificial neural network
Yang Shen et al.
JOURNAL OF BIOMOLECULAR NMR (2010)
A non-natural variant of human lysozyme (I59T) mimics the in vitro behaviour of the I56T variant that is responsible for a form of familial amyloidosis
Christine L. Hagan et al.
PROTEIN ENGINEERING DESIGN & SELECTION (2010)
Structures of partridge egg-white lysozyme with and without tri-N-acetylchitotriose inhibitor at 1.9 Å resolution
M. A. Turner et al.
PROTEIN SCIENCE (2010)
Improved side-chain torsion potentials for the Amber ff99SB protein force field
Kresten Lindorff-Larsen et al.
PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS (2010)
A Transient and Low-Populated Protein-Folding Intermediate at Atomic Resolution
Dmitry M. Korzhnev et al.
SCIENCE (2010)
Optimized Molecular Dynamics Force Fields Applied to the Helix-Coil Transition of Polypeptides
Robert B. Best et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2009)
Toward an Accurate Determination of Free Energy Landscapes in Solution States of Proteins
Alfonso De Simone et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2009)
P-LINCS: A parallel linear constraint solver for molecular simulation
Berk Hess
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2008)
Recognition dynamics up to microseconds revealed from an RDC-derived ubiquitin ensemble in solution
Oliver F. Lange et al.
SCIENCE (2008)
GLYCAM06: A generalizable Biomolecular force field. Carbohydrates
Karl N. Kirschner et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2008)
Canonical sampling through velocity rescaling
Giovanni Bussi et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Simultaneous determination of protein backbone structure and dynamics from residual dipolar couplings
Guillaume Bouvignies et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2006)
Visualization of transient encounter complexes in protein-protein association
Chun Tang et al.
NATURE (2006)
Rationalising lysozyme amyloidosis: Insights from the structure and solution dynamics of T70N lysozyme
RJK Johnson et al.
JOURNAL OF MOLECULAR BIOLOGY (2005)
How much backbone motion in ubiquitin is required to account for dipolar coupling data measured in multiple alignment media as assessed by independent cross-validation?
GM Clore et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2004)
Amplitudes of protein backbone dynamics and correlated motions in a small α/β protein:: Correspondence of dipolar coupling and heteronuclear relaxation measurements
GM Clore et al.
BIOCHEMISTRY (2004)
Low-populated folding intermediates of Fyn SH3 characterized by relaxation dispersion NMR
DM Korzhnev et al.
NATURE (2004)
Catalysis by hen egg-white lysozyme proceeds via a covalent intermediate
DJ Vocadlo et al.
NATURE (2001)
A refined solution structure of hen lysozyme determined using residual dipolar coupling data
H Schwalbe et al.
PROTEIN SCIENCE (2001)