LAMMPS

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• LAMMPS — ( Large scale Atomic/Molecular Massively Parallel Simulator ) is a molecular dynamics program from Sandia National Laboratories. LAMMPS makes use of MPI for parallel communication and is a free open source code, distributed under the terms of the …   Wikipedia

• Lammps — Тип Молекулярная динамика Разработчик Sandia National Laboratories Операционная система Кроссплатформенный Последняя версия Rolling release Лицензия GPL Сайт …   Википедия

• SLinCA@Home — Тип Грид, распределенные вычисления, волонтёрские …   Википедия

• Discrete element method — A discrete element method (DEM), also called a distinct element method is any of family of numerical methods for computing the motion of a large number of particles of micrometre scale size and above. Though DEM is very closely related to… …   Wikipedia

• Embedded atom model — In computational chemistry, the embedded atom model, or EAM is an approximation describing the energy between two atoms. The energy is a function of a sum of functions of the separation between an atom and its neighbors. In the original model, by …   Wikipedia

• Molecular dynamics — (MD) is a computer simulation of physical movements of atoms and molecules. The atoms and molecules are allowed to interact for a period of time, giving a view of the motion of the atoms. In the most common version, the trajectories of molecules… …   Wikipedia

• Case Western Reserve University — Motto Thinking Beyond the Possible Established WRU: 1826 CIT: 1880 CWRU: 1967 Type …   Wikipedia

• Molecular mechanics — A force field is used to minimize the bond stretching energy of this ethane molecule. Molecular mechanics uses Newtonian mechanics to model molecular systems. The potential energy of all systems in molecular mechanics is calculated using force… …   Wikipedia

• Molecular modelling — The backbone dihedral angles are included in the molecular model of a protein. Modelling of ionic li …   Wikipedia

• OPLS — This article is about Optimized Potentials for Liquid Simulations. For Orthogonal Projections to Latent Structures, see Partial least squares regression#Extensions. The OPLS (Optimized Potentials for Liquid Simulations) force field was developed… …   Wikipedia

• Dissipative particle dynamics — (DPD) is a stochastic simulation technique for simulating the dynamic and rheological properties of simple and complex fluids. It was initially devised by Hoogerbrugge and Koelman [1][2] to avoid the lattice artifacts of the so called lattice gas …   Wikipedia