The energy landscapes and motions of proteins
H Frauenfelder, SG Sligar, PG Wolynes - Science, 1991 - science.org
Recent experiments, advances in theory, and analogies to other complex systems such as
glasses and spin glasses yield insight into protein dynamics. The basis of the understanding …
glasses and spin glasses yield insight into protein dynamics. The basis of the understanding …
Monte Carlo-minimization approach to the multiple-minima problem in protein folding.
Z Li, HA Scheraga - … of the National Academy of Sciences, 1987 - National Acad Sciences
A Monte Carlo-minimization method has been developed to overcome the multiple-minima
problem. The Metropolis Monte Carlo sampling, assisted by energy minimization, surmounts …
problem. The Metropolis Monte Carlo sampling, assisted by energy minimization, surmounts …
Molecular dynamics of water at the protein− solvent interface
AR Bizzarri, S Cannistraro - The Journal of Physical Chemistry B, 2002 - ACS Publications
The use of molecular dynamics simulation to investigate the properties of hydration water
around proteins is outlined. A variety of structural and dynamical properties of the protein …
around proteins is outlined. A variety of structural and dynamical properties of the protein …
Analysis of the backbone dynamics of interleukin-1. beta. using two-dimensional inverse detected heteronuclear nitrogen-15-proton NMR spectroscopy
GM Clore, PC Driscoll, PT Wingfield… - Biochemistry, 1990 - ACS Publications
Revised Manuscript Received May 1, 1990 abstract: The backbone dynamics of uniformly
15N-labeled interleukin-1/3 are investigated by using two-dimensional inverse detected …
15N-labeled interleukin-1/3 are investigated by using two-dimensional inverse detected …
Protein dynamics in enzymatic catalysis: exploration of dihydrofolate reductase
JL Radkiewicz, CL Brooks - Journal of the American Chemical …, 2000 - ACS Publications
The overall motions and atomic fluctuations of DHFR are calculated using molecular
dynamics simulations to explore potential links between catalysis and dynamics in this …
dynamics simulations to explore potential links between catalysis and dynamics in this …
Ligand binding to heme proteins: connection between dynamics and function
Department of Physics, University of Illinois at Urbana-Champaign, 1110 West Green Street,
Urbana, Illinois 61801 Received August 6, 1990; Revised Manuscript Received November …
Urbana, Illinois 61801 Received August 6, 1990; Revised Manuscript Received November …
Aspects of protein reaction dynamics: Deviations from simple behavior
M Karplus - The Journal of Physical Chemistry B, 2000 - ACS Publications
Proteins are complex systems so that their reactions may have characteristics not often
observed in small molecules. Two common aspects of small molecule reactions are an …
observed in small molecules. Two common aspects of small molecule reactions are an …
Nonlinear kinetics and new approaches to complex reaction mechanisms
J Ross, MO Vlad - Annual review of physical chemistry, 1999 - annualreviews.org
▪ Abstract This paper reviews recent developments in the field of nonlinear chemical kinetics.
Five topics are dealt with:(a) new approaches to complex reaction mechanisms …
Five topics are dealt with:(a) new approaches to complex reaction mechanisms …
Structure and free energy of complex thermodynamic systems
Z Li, HA Scheraga - Journal of Molecular Structure: THEOCHEM, 1988 - Elsevier
Biological systems are intrinsically complex, involving many degrees of freedom,
heterogeneity, and strong interactions among components. For the simplest of biological …
heterogeneity, and strong interactions among components. For the simplest of biological …
Cationic redistribution induced spin-glass and cluster-glass states in spinel ferrite
The effect of the cationic redistribution on the complex spinel structure and magnetic
properties were investigated in Zn 0.7 Cu 0.3 Fe 2 O 4 ferrite. X-ray photoelectron …
properties were investigated in Zn 0.7 Cu 0.3 Fe 2 O 4 ferrite. X-ray photoelectron …