aDo you want to go back to China with me? 您是否想要去回到中国与我?[translate] aDoppler 多谱勒仪[translate] aI discovered your lies as the moment you say it 我发现了您的谎言,片刻您说它[translate] ainteractive molecular dynamics (IMD) 交互式分子动力学(IMD)[translate]...
Interactive Molecular Dynamics: Scaling up to Large Systems. Procedia Comput. Sci. 2013, 18, 20-29.Dreher, M., Piuzzi, M., Ahmed, T., Matthieu, C., Baaden, M., F´erey, N., Limet, S., Raffin, B., Robert, S.: Interactive Molecular Dynamics: Scaling up to Large Sys- tems...
Visual Interactive Analysis of Molecular Dynamics VIAMD is an interactive analysis tool for molecular dynamics (MD) written in C/C++. VIAMD is developed in collaboration with the Department for Media and Information Technology (LIU, Norrköping) and the PDC Center for High Performance Computing (...
IMD (Interactive Molecular Dynamics) is supported natively in GROMACS and VMD. MDDriver is no longer needed for this kind of simulation.MDDriver is compatible with this IMD protocol used by VMD and GROMACS. These 3 components (UnityMol, MDDriver and Biospring) have been used together recently...
Analyzing molecular dynamics (MD) simulations is a key aspect to understand protein dynamics and function. With increasing computational power, it is now possible to generate very long and complex simulations, which are cumbersome to explore using traditional 3D animations of protein movements. Guided ...
PLUMED-GUI is an interactive environment to develop and test complex PLUMED scripts within the Visual Molecular Dynamics (VMD) environment. Computational biophysicists can take advantage of both PLUMED's rich syntax to define collective variables (CVs) and VMD's chemically-aware atom selection ...
PLUMED-GUI is an interactive environment to develop and test complex PLUMED scripts within the Visual Molecular Dynamics (VMD) environment. Computational biophysicists can take advantage of both PLUMED's rich syntax to define collective variables (CVs) and VMD's chemically-aware atom selection language...
Abstract NGLview is a Jupyter/IPython widget to interactively view molecular structures as well as trajectories from molecular dynamics simulations. Fast and scalable molecular graphics are provided through the NGL Viewer. The widget supports showing data from the file-system, online data bases and from...
However, it is unknown how these findings translate to the interactive dynamics of gaze behavior during "face-to-face" encounters between two individuals. Only by analyzing the gaze behaviour of both interaction partners is it possible to determine the frequency of actual eye-contact and who ...
Here we present a game-changing technology, opening up the way for fast reliable simulations of protein dynamics by combining an adaptive reinforcement learning procedure with Monte Carlo sampling in the frame of modern multi-core computational resources. We show remarkable performance in mapping the ...