Add to ORKGComputer simulation of polymer chain is carried out by Monte Carlo method in this paper. The properties of polymer chain are simulated by self avoiding walk and bond fluctuation model. The parallel computing model is established to solve the physical problems of the polymer chains. We analyze the algorithms for polymer chains to parallel computing at high performance computing center. Gustafson law is analyzed and is applied to obtain linear speedup
A system of efficient computer programs has been developed for simulating the conformations of macro...
High-fidelity models of polymer processes should include the prediction of distributions of polymer ...
We develop the hybrid Monte Carlo method for simulations of single off-lattice polymer chains. We di...
A novel, parallelised approach to Monte Carlo simulations for the computation of full molecular weig...
A novel, parallelised approach to Monte Carlo simulations for the computation of full molecular weig...
Molecular dynamics simulation has become an important tool for testing and developing hypotheses abo...
Molecular dynamics simulation has become an important tool for testing and developing hypotheses abo...
AbstractWe investigate new programming techniques for parallel tempering Monte Carlo simulations of ...
Predicting chain microstructure became an important task for polymer scientists. Polydisperse nature...
We have developed and implemented parallel algorithms for the molecular dynamics simulation of synth...
This thesis considers confined polymer systems. These systems are of considerable interest, e.g., th...
The new multibond algorithm for the Monte Carlo simulations of polymers developed for an isolated ch...
Algorithms developed to enable the use of atomistic molecular simulation methods with parallel compu...
Polymers is a class of molecules which can have many different structures due to a large number of d...
A novel algorithm is developed for the simulation of polymer chains suspended in a solvent. The poly...
A system of efficient computer programs has been developed for simulating the conformations of macro...
High-fidelity models of polymer processes should include the prediction of distributions of polymer ...
We develop the hybrid Monte Carlo method for simulations of single off-lattice polymer chains. We di...
A novel, parallelised approach to Monte Carlo simulations for the computation of full molecular weig...
A novel, parallelised approach to Monte Carlo simulations for the computation of full molecular weig...
Molecular dynamics simulation has become an important tool for testing and developing hypotheses abo...
Molecular dynamics simulation has become an important tool for testing and developing hypotheses abo...
AbstractWe investigate new programming techniques for parallel tempering Monte Carlo simulations of ...
Predicting chain microstructure became an important task for polymer scientists. Polydisperse nature...
We have developed and implemented parallel algorithms for the molecular dynamics simulation of synth...
This thesis considers confined polymer systems. These systems are of considerable interest, e.g., th...
The new multibond algorithm for the Monte Carlo simulations of polymers developed for an isolated ch...
Algorithms developed to enable the use of atomistic molecular simulation methods with parallel compu...
Polymers is a class of molecules which can have many different structures due to a large number of d...
A novel algorithm is developed for the simulation of polymer chains suspended in a solvent. The poly...
A system of efficient computer programs has been developed for simulating the conformations of macro...
High-fidelity models of polymer processes should include the prediction of distributions of polymer ...
We develop the hybrid Monte Carlo method for simulations of single off-lattice polymer chains. We di...
