Results 211 to 220 of about 312,196 (245)
Drug repurposing against fucosyltransferase-2 via docking, STD-NMR, and molecular dynamic simulation studies. [PDF]
PLoS OneAtif M, Zafar H, Wahab AT, Choudhary MI.
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Molecular Dynamics Simulations
Current Opinion in Structural Biology, 2002Molecular dynamics simulations have become a standard tool for the investigation of biomolecules. Simulations are performed of ever bigger systems using more realistic boundary conditions and better sampling due to longer sampling times. Recently, realistic simulations of systems as complex as transmembrane channels have become feasible.
Daan Frenkel, Berend Smit
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Interfacing Brownian dynamics simulations
The Journal of Chemical Physics, 2004Starting from the flux of particles in a Brownian dynamics simulation we derive boundary conditions, which allow us (i) to couple a Brownian dynamics calculation to a reservoir of particles of a given density, i.e., setting up constant density boundary conditions, and (ii) to build an interface between Brownian dynamics and a diffusional treatment of ...
T, Geyer, C, Gorba, V, Helms
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Distributed Dynamic Process Simulation
ZAMM - Journal of Applied Mathematics and Mechanics / Zeitschrift für Angewandte Mathematik und Mechanik, 2001AbstractIn chemical process industry a heterogeneous simulation concept is required which distributes the solution of a dynamic overall model to a computer network such that the submodels of the global process flowsheet can be solved independently of each other on subsequent time intervals.
Ehrhardt, K. +3 more
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Direct Chemical Dynamics Simulations
Journal of the American Chemical Society, 2017In a direct dynamics simulation, the technologies of chemical dynamics and electronic structure theory are coupled so that the potential energy, gradient, and Hessian required from the simulation are obtained directly from the electronic structure theory.
Subha, Pratihar +4 more
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Journal of Robotic Systems, 1984
AbstractThe ability to mathematically model the movement of a robot manipulator is a prerequisite to the understanding of the key factors that influence a manipulator's performance. This paper presents a manipulator model which has been used to simulate and control a real robot arm. A method of describing the arm by its rotational characteristics.
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AbstractThe ability to mathematically model the movement of a robot manipulator is a prerequisite to the understanding of the key factors that influence a manipulator's performance. This paper presents a manipulator model which has been used to simulate and control a real robot arm. A method of describing the arm by its rotational characteristics.
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Molecular Dynamics Simulations
2008Molecular simulation is a very powerful toolbox in modern molecular modeling, and enables us to follow and understand structure and dynamics with extreme detail--literally on scales where motion of individual atoms can be tracked. This chapter focuses on the two most commonly used methods, namely, energy minimization and molecular dynamics, that ...
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Dynamic stall simulation problems
Guidance, Control and Flight Mechanics Conference, 1970Dynamic airfoil stall simulation in wind tunnels, considering pitch rate, Reynolds number, oscillation and test equipment ...
LARS E. ERICSSON, J. PETER REDING
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2020 International Conference on Virtual Reality and Visualization (ICVRV), 2020
This article introduces a dynamic flight simulator. The dynamic flight simulator is composed of three-degree-of-freedom platform, flight seat, flight stick, VR glasses, physical simulation platform and other equipment. Experienced people operate the flight joystick, and can experience realistic flight vision through VR glasses.
Jinpeng Zhang +2 more
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This article introduces a dynamic flight simulator. The dynamic flight simulator is composed of three-degree-of-freedom platform, flight seat, flight stick, VR glasses, physical simulation platform and other equipment. Experienced people operate the flight joystick, and can experience realistic flight vision through VR glasses.
Jinpeng Zhang +2 more
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