Monte Carlo Calculation of the Average Extension of Molecular Chains
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Accelerated convergence of molecular free energy via superposition approximation-based reference statesLattice protein folding with two and four-body statistical potentials.Rapid sampling of all-atom peptides using a library-based polymer-growth approach.Investigation of the chromosome regions with significant affinity for the nuclear envelope in fruit fly--a model based approach.Role of histone tails in chromatin folding revealed by a mesoscopic oligonucleosome model.Fast protein loop sampling and structure prediction using distance-guided sequential chain-growth Monte Carlo method.A Looping-Based Model for Quenching Repression.Crucial role of dynamic linker histone binding and divalent ions for DNA accessibility and gene regulation revealed by mesoscale modeling of oligonucleosomes.The early crystal nucleation process in hard spheres shows synchronised ordering and densification.Generating properly weighted ensemble of conformations of proteins from sparse or indirect distance constraints.Growth algorithm for finding low energy configurations of simple lattice proteins.Structure optimization in an off-lattice protein model.On the vapor-liquid equilibrium of attractive chain fluids with variable degree of molecular flexibility.Statistical geometry of lattice chain polymers with voids of defined shapes: sampling with strong constraints.Absolute free energies and equilibrium ensembles of dense fluids computed from a nondynamic growth method.Application of importance sampling to the computation of large deviations in nonequilibrium processes.Improving the efficiency of configurational-bias Monte Carlo: a density-guided method for generating bending angle trials for linear and branched molecules.Chain architecture and micellization: a mean-field coarse-grained model for poly(ethylene oxide) alkyl ether surfactants.Critical adsorption of a flexible polymer confined between two parallel interacting surfaces.Machine learning of single molecule free energy surfaces and the impact of chemistry and environment upon structure and dynamics.Reconstructing atomistic detail for coarse-grained models with resolution exchange.Molecular dynamics simulations of transport and separation of carbon dioxide-alkane mixtures in carbon nanopores.Method for sampling compact configurations for semistiff polymers.A New Method to Predict Ion Effects in RNA Folding.Computation of a chemical potential using a residence weight algorithm.An analytical approximation for the orientation-dependent excluded volume of tangent hard sphere chains of arbitrary chain length and flexibility.Efficient global biopolymer sampling with end-transfer configurational bias Monte Carlo.Algorithmic generation of freely jointed hard sphere chains and properties of their inertial tensors.Collapse transition in polymer models with multiple monomers per site and multiple bonds per edge.Determination of the critical micelle concentration in simulations of surfactant systems.Shape selection in chiral self-assembly.Monte Carlo simulation and molecular theory of tethered polyelectrolytes.Self-avoiding wormlike chain model for double-stranded-DNA loop formation.Free energy calculations, enhanced by a Gaussian ansatz, for the "chemical work" distribution.Effective short-range Coulomb correction to model the aggregation behavior of ionic surfactants.Incorporating configurational-bias Monte Carlo into the Wang-Landau algorithm for continuous molecular systems.Rejection-free Monte Carlo scheme for anisotropic particles.A multiple replica approach to simulate reactive trajectories.Molecular simulations of confined liquids: an alternative to the grand canonical Monte Carlo simulations.Simulation of the effects of chain architecture on the sorption of ethylene in polyethylene.
P2860
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P2860
Monte Carlo Calculation of the Average Extension of Molecular Chains
description
im Februar 1955 veröffentlichter wissenschaftlicher Artikel
@de
wetenschappelijk artikel
@nl
наукова стаття, опублікована в лютому 1955
@uk
name
Monte Carlo Calculation of the Average Extension of Molecular Chains
@en
Monte Carlo Calculation of the Average Extension of Molecular Chains
@nl
type
label
Monte Carlo Calculation of the Average Extension of Molecular Chains
@en
Monte Carlo Calculation of the Average Extension of Molecular Chains
@nl
prefLabel
Monte Carlo Calculation of the Average Extension of Molecular Chains
@en
Monte Carlo Calculation of the Average Extension of Molecular Chains
@nl
P356
P1476
Monte Carlo Calculation of the Average Extension of Molecular Chains
@en
P2093
Arianna W. Rosenbluth
Marshall N. Rosenbluth
P304
P356
10.1063/1.1741967
P407
P577
1955-02-01T00:00:00Z